Analytenname

Dehydroxy-(2-methyl-4-(2-methylbenzamido)benzoate) Tolvaptan

CAS-Nummer

1580889-36-6

Molekularformel

C42 H36 Cl N3 O5

Molekulargewicht

698.205

Genaue Masse

697.234

SMILES

Cc1ccccc1C(=O)Nc2ccc(C(=O)OC3=CCCN(C(=O)c4ccc(NC(=O)c5ccccc5C)cc4C)c6ccc(Cl)cc36)c(C)c2

InChI

InChI=1S/C42H36ClN3O5/c1-25-10-5-7-12-32(25)39(47)44-30-16-18-34(27(3)22-30)41(49)46-21-9-14-38(36-24-29(43)15-20-37(36)46)51-42(50)35-19-17-31(23-28(35)4)45-40(48)33-13-8-6-11-26(33)2/h5-8,10-20,22-24H,9,21H2,1-4H3,(H,44,47)(H,45,48)

IUPAC

[7-chloro-1-[2-methyl-4-[(2-methylbenzoyl)amino]benzoyl]-2,3-dihydro-1-benzazepin-5-yl] 2-methyl-4-[(2-methylbenzoyl)amino]benzoate

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produkttyp

Impurity

Produktformat

Neat