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

Systemtic Name: N-[4-[(7-chloranyl-2,3,4,5-tetrahydro-1-benzazepin-1-yl)carbonyl]-2-methoxy-phenyl]-2-[4-(4-ethanoylpiperazin-1-yl)butoxy]benzamide Openeye Name: 2-[4-(4-acetylpiperazin-1-yl)butoxy]-N-[4-(7-chloro-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)-2-methoxy-phenyl]benzamide CAS Name: 2-[4-(4-acetyl-1-piperazinyl)butoxy]-N-[4-[(7-chloro-2,3,4,5-tetrahydro-1-benzazepin-1-yl)-oxomethyl]-2-methoxyphenyl]benzamide IUPAC Name: 2-[4-(4-acetylpiperazin-1-yl)butoxy]-N-[4-(7-chloro-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)-2-methoxyphenyl]benzamide Traditional Name: 2-[4-(4-acetylpiperazino)butoxy]-N-[4-(7-chloro-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)-2-methoxy-phenyl]benzamide Formula: C35H41ClN4O5 MolecularWeight: 633.17684

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CCCCOC2=CC=CC=C2C(=O)NC3=C(C=C(C=C3)C(=O)N4CCCCC5=C4C=CC(=C5)Cl)OC

Isomeric SMILES

CC(=O)N1CCN(CC1)CCCCOC2=CC=CC=C2C(=O)NC3=C(C=C(C=C3)C(=O)N4CCCCC5=C4C=CC(=C5)Cl)OC

InChI

InChI=1S/C35H41ClN4O5/c1-25(41)39-20-18-38(19-21-39)16-7-8-22-45-32-11-4-3-10-29(32)34(42)37-30-14-12-27(24-33(30)44-2)35(43)40-17-6-5-9-26-23-28(36)13-15-31(26)40/h3-4,10-15,23-24H,5-9,16-22H2,1-2H3,(H,37,42)