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

Systemtic Name: [7-chloranyl-1-[4-[(2-methylphenyl)carbonylamino]phenyl]carbonyl-2,3,4,5-tetrahydro-1-benzazepin-5-yl]methyl 2-(dimethylamino)ethanoate Openeye Name: [7-chloro-1-[4-[(2-methylbenzoyl)amino]benzoyl]-2,3,4,5-tetrahydro-1-benzazepin-5-yl]methyl 2-(dimethylamino)acetate CAS Name: 2-(dimethylamino)acetic acid [7-chloro-1-[[4-[[(2-methylphenyl)-oxomethyl]amino]phenyl]-oxomethyl]-2,3,4,5-tetrahydro-1-benzazepin-5-yl]methyl ester IUPAC Name: [7-chloro-1-[4-[(2-methylbenzoyl)amino]benzoyl]-2,3,4,5-tetrahydro-1-benzazepin-5-yl]methyl 2-(dimethylamino)acetate Traditional Name: 2-(dimethylamino)acetic acid [7-chloro-1-[4-(o-toluoylamino)benzoyl]-2,3,4,5-tetrahydro-1-benzazepin-5-yl]methyl ester Formula: C30H32ClN3O4 MolecularWeight: 534.04578

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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)COC(=O)CN(C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)N3CCCC(C4=C3C=CC(=C4)Cl)COC(=O)CN(C)C

InChI

InChI=1S/C30H32ClN3O4/c1-20-7-4-5-9-25(20)29(36)32-24-13-10-21(11-14-24)30(37)34-16-6-8-22(19-38-28(35)18-33(2)3)26-17-23(31)12-15-27(26)34/h4-5,7,9-15,17,22H,6,8,16,18-19H2,1-3H3,(H,32,36)