1-[4-methyl-1-[(5-methyl-6-oxidanylidene-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxidanylidene-pentan-2-yl]cyclopent-3-ene-1-carboxylic acid

Systemtic Name: 1-[4-methyl-1-[(5-methyl-6-oxidanylidene-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxidanylidene-pentan-2-yl]cyclopent-3-ene-1-carboxylic acid Openeye Name: 1-[3-methyl-1-[(5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl)carbamoyl]butyl]cyclopent-3-ene-1-carboxylic acid CAS Name: 1-[4-methyl-1-[(5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxopentan-2-yl]-1-cyclopent-3-enecarboxylic acid IUPAC Name: 1-[4-methyl-1-[(5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxopentan-2-yl]cyclopent-3-ene-1-carboxylic acid Traditional Name: 1-[1-[(6-keto-5-methyl-7H-benzo[d][1]benzazepin-7-yl)carbamoyl]-3-methyl-butyl]cyclopent-3-ene-1-carboxylic acid Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1C2=CC=CC=C2C3=CC=CC=C3N(C1=O)C)C4(CC=CC4)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)NC1C2=CC=CC=C2C3=CC=CC=C3N(C1=O)C)C4(CC=CC4)C(=O)O

InChI

InChI=1S/C27H30N2O4/c1-17(2)16-21(27(26(32)33)14-8-9-15-27)24(30)28-23-20-12-5-4-10-18(20)19-11-6-7-13-22(19)29(3)25(23)31/h4-13,17,21,23H,14-16H2,1-3H3,(H,28,30)(H,32,33)