7-[4-(3-carboxy-1,8-dimethyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-7-yl)piperazin-1-yl]-1,8-dimethyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid

Systemtic Name: 7-[4-(3-carboxy-1,8-dimethyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-7-yl)piperazin-1-yl]-1,8-dimethyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid Openeye Name: 7-[4-(3-carboxy-1,8-dimethyl-2-oxo-4,5-dihydro-3H-1-benzazepin-7-yl)piperazin-1-yl]-1,8-dimethyl-2-oxo-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid CAS Name: 7-[4-(3-carboxy-1,8-dimethyl-2-oxo-4,5-dihydro-3H-1-benzazepin-7-yl)-1-piperazinyl]-1,8-dimethyl-2-oxo-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid IUPAC Name: 7-[4-(3-carboxy-1,8-dimethyl-2-oxo-4,5-dihydro-3H-1-benzazepin-7-yl)piperazin-1-yl]-1,8-dimethyl-2-oxo-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid Traditional Name: 7-[4-(3-carboxy-2-keto-1,8-dimethyl-4,5-dihydro-3H-1-benzazepin-7-yl)piperazino]-2-keto-1,8-dimethyl-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid Formula: C30H36N4O6 MolecularWeight: 548.63004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2CCC(C(=O)N(C2=C1)C)C(=O)O)N3CCN(CC3)C4=C(C=C5C(=C4)CCC(C(=O)N5C)C(=O)O)C

Isomeric SMILES

CC1=C(C=C2CCC(C(=O)N(C2=C1)C)C(=O)O)N3CCN(CC3)C4=C(C=C5C(=C4)CCC(C(=O)N5C)C(=O)O)C

InChI

InChI=1S/C30H36N4O6/c1-17-13-25-19(5-7-21(29(37)38)27(35)31(25)3)15-23(17)33-9-11-34(12-10-33)24-16-20-6-8-22(30(39)40)28(36)32(4)26(20)14-18(24)2/h13-16,21-22H,5-12H2,1-4H3,(H,37,38)(H,39,40)