tert-butyl 1-[3-cyclopropyl-1-[(5-methyl-6-oxidanylidene-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxidanylidene-propan-2-yl]cyclopent-3-ene-1-carboxylate

Systemtic Name: tert-butyl 1-[3-cyclopropyl-1-[(5-methyl-6-oxidanylidene-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxidanylidene-propan-2-yl]cyclopent-3-ene-1-carboxylate Openeye Name: tert-butyl 1-[1-(cyclopropylmethyl)-2-[(5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl)amino]-2-oxo-ethyl]cyclopent-3-ene-1-carboxylate CAS Name: 1-[3-cyclopropyl-1-[(5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxopropan-2-yl]-1-cyclopent-3-enecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[3-cyclopropyl-1-[(5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl)amino]-1-oxopropan-2-yl]cyclopent-3-ene-1-carboxylate Traditional Name: 1-[1-(cyclopropylmethyl)-2-keto-2-[(6-keto-5-methyl-7H-benzo[d][1]benzazepin-7-yl)amino]ethyl]cyclopent-3-ene-1-carboxylic acid tert-butyl ester Formula: C31H36N2O4 MolecularWeight: 500.62854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(CC=CC1)C(CC2CC2)C(=O)NC3C4=CC=CC=C4C5=CC=CC=C5N(C3=O)C

Isomeric SMILES

CC(C)(C)OC(=O)C1(CC=CC1)C(CC2CC2)C(=O)NC3C4=CC=CC=C4C5=CC=CC=C5N(C3=O)C

InChI

InChI=1S/C31H36N2O4/c1-30(2,3)37-29(36)31(17-9-10-18-31)24(19-20-15-16-20)27(34)32-26-23-13-6-5-11-21(23)22-12-7-8-14-25(22)33(4)28(26)35/h5-14,20,24,26H,15-19H2,1-4H3,(H,32,34)