Ivabradine hydrochloride impurity V[盐酸伊伐布雷定杂质V]

304462-60-0

CAS Name

3-[3-[[[(7S)-3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl]methyl]methylamino]propyl]-1,3,4,5-tetrahydro-7-hydroxy-8-methoxy-2H-3-benzazepin-2-one

Molecular Formula

C₂₆H₃₄N₂O₅

Molecular Mass

454.56

Other Names and Identifiers

InChI

InChI=1S/C26H34N2O5/c1-27(16-20-10-19-13-24(32-3)25(33-4)15-21(19)20)7-5-8-28-9-6-17-11-22(29)23(31-2)12-18(17)14-26(28)30/h11-13,15,20,29H,5-10,14,16H2,1-4H3/t20-/m1/s1

InChIKey

InChIKey=QBMUBWFMPCQUGQ-HXUWFJFHSA-N

SMILES

C(N(CCCN1C(=O)CC=2C(CC1)=CC(O)=C(OC)C2)C)[C@@H]3C=4C(C3)=CC(OC)=C(OC)C4

Canonical SMILES

O=C1N(CCC2=CC(O)=C(OC)C=C2C1)CCCN(C)CC3C4=CC(OC)=C(OC)C=C4C3

Other Names for this Substance