2-[4-[[7-chloranyl-5-[2-(4-ethylpiperazin-1-yl)-2-oxidanylidene-ethoxy]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]carbonyl]phenyl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-[4-[[7-chloranyl-5-[2-(4-ethylpiperazin-1-yl)-2-oxidanylidene-ethoxy]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]carbonyl]phenyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[4-[7-chloro-5-[2-(4-ethylpiperazin-1-yl)-2-oxo-ethoxy]-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]phenyl]-3,4-dihydroisoquinolin-1-one CAS Name: 2-[4-[[7-chloro-5-[2-(4-ethyl-1-piperazinyl)-2-oxoethoxy]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-oxomethyl]phenyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[4-[7-chloro-5-[2-(4-ethylpiperazin-1-yl)-2-oxoethoxy]-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]phenyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[4-[7-chloro-5-[2-(4-ethylpiperazino)-2-keto-ethoxy]-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]phenyl]-3,4-dihydroisocarbostyril Formula: C34H37ClN4O4 MolecularWeight: 601.13498

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)COC2CCCN(C3=C2C=C(C=C3)Cl)C(=O)C4=CC=C(C=C4)N5CCC6=CC=CC=C6C5=O

Isomeric SMILES

CCN1CCN(CC1)C(=O)COC2CCCN(C3=C2C=C(C=C3)Cl)C(=O)C4=CC=C(C=C4)N5CCC6=CC=CC=C6C5=O

InChI

InChI=1S/C34H37ClN4O4/c1-2-36-18-20-37(21-19-36)32(40)23-43-31-8-5-16-39(30-14-11-26(35)22-29(30)31)33(41)25-9-12-27(13-10-25)38-17-15-24-6-3-4-7-28(24)34(38)42/h3-4,6-7,9-14,22,31H,2,5,8,15-21,23H2,1H3