[7-chloranyl-1-[2-methyl-4-[(2-methylphenyl)carbonylamino]phenyl]carbonyl-2,3,4,5-tetrahydro-1-benzazepin-5-yl] 2-(4-ethanoylpiperazin-1-yl)ethanoate hydrochloride

Systemtic Name: [7-chloranyl-1-[2-methyl-4-[(2-methylphenyl)carbonylamino]phenyl]carbonyl-2,3,4,5-tetrahydro-1-benzazepin-5-yl] 2-(4-ethanoylpiperazin-1-yl)ethanoate hydrochloride Openeye Name: [7-chloro-1-[2-methyl-4-[(2-methylbenzoyl)amino]benzoyl]-2,3,4,5-tetrahydro-1-benzazepin-5-yl] 2-(4-acetylpiperazin-1-yl)acetate hydrochloride CAS Name: 2-(4-acetyl-1-piperazinyl)acetic acid [7-chloro-1-[[2-methyl-4-[[(2-methylphenyl)-oxomethyl]amino]phenyl]-oxomethyl]-2,3,4,5-tetrahydro-1-benzazepin-5-yl] ester hydrochloride IUPAC Name: [7-chloro-1-[2-methyl-4-[(2-methylbenzoyl)amino]benzoyl]-2,3,4,5-tetrahydro-1-benzazepin-5-yl] 2-(4-acetylpiperazin-1-yl)acetate hydrochloride Traditional Name: 2-(4-acetylpiperazino)acetic acid [7-chloro-1-[2-methyl-4-(o-toluoylamino)benzoyl]-2,3,4,5-tetrahydro-1-benzazepin-5-yl] ester hydrochloride Formula: C34H38Cl2N4O5 MolecularWeight: 653.59532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)C(=O)N3CCCC(C4=C3C=CC(=C4)Cl)OC(=O)CN5CCN(CC5)C(=O)C)C.Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC(=C(C=C2)C(=O)N3CCCC(C4=C3C=CC(=C4)Cl)OC(=O)CN5CCN(CC5)C(=O)C)C.Cl

InChI

InChI=1S/C34H37ClN4O5.ClH/c1-22-7-4-5-8-27(22)33(42)36-26-11-12-28(23(2)19-26)34(43)39-14-6-9-31(29-20-25(35)10-13-30(29)39)44-32(41)21-37-15-17-38(18-16-37)24(3)40;/h4-5,7-8,10-13,19-20,31H,6,9,14-18,21H2,1-3H3,(H,36,42);1H