N-[4-[[7-chloranyl-2-[2-(4-ethanoylpiperazin-1-yl)ethoxy]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]carbonyl]-3-methoxy-phenyl]-2-methyl-benzamide hydrochloride

Systemtic Name: N-[4-[[7-chloranyl-2-[2-(4-ethanoylpiperazin-1-yl)ethoxy]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]carbonyl]-3-methoxy-phenyl]-2-methyl-benzamide hydrochloride Openeye Name: N-[4-[2-[2-(4-acetylpiperazin-1-yl)ethoxy]-7-chloro-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methoxy-phenyl]-2-methyl-benzamide hydrochloride CAS Name: N-[4-[[2-[2-(4-acetyl-1-piperazinyl)ethoxy]-7-chloro-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-oxomethyl]-3-methoxyphenyl]-2-methylbenzamide hydrochloride IUPAC Name: N-[4-[2-[2-(4-acetylpiperazin-1-yl)ethoxy]-7-chloro-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methoxyphenyl]-2-methylbenzamide hydrochloride Traditional Name: N-[4-[2-[2-(4-acetylpiperazino)ethoxy]-7-chloro-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]-3-methoxy-phenyl]-2-methyl-benzamide hydrochloride Formula: C34H40Cl2N4O5 MolecularWeight: 655.6112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)C(=O)N3C(CCCC4=C3C=CC(=C4)Cl)OCCN5CCN(CC5)C(=O)C)OC.Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)C(=O)N3C(CCCC4=C3C=CC(=C4)Cl)OCCN5CCN(CC5)C(=O)C)OC.Cl

InChI

InChI=1S/C34H39ClN4O5.ClH/c1-23-7-4-5-9-28(23)33(41)36-27-12-13-29(31(22-27)43-3)34(42)39-30-14-11-26(35)21-25(30)8-6-10-32(39)44-20-19-37-15-17-38(18-16-37)24(2)40;/h4-5,7,9,11-14,21-22,32H,6,8,10,15-20H2,1-3H3,(H,36,41);1H