tert-butyl 4-[2-(11-acetyloxy-6-oxidanylidene-11H-benzo[c][1]benzazepin-5-yl)ethanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(11-acetyloxy-6-oxidanylidene-11H-benzo[c][1]benzazepin-5-yl)ethanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(11-acetoxy-6-oxo-11H-benzo[c][1]benzazepin-5-yl)acetyl]piperazine-1-carboxylate CAS Name: 4-[2-(11-acetyloxy-6-oxo-11H-benzo[c][1]benzazepin-5-yl)-1-oxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(11-acetyloxy-6-oxo-11H-benzo[c][1]benzazepin-5-yl)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(11-acetoxy-6-keto-11H-benzo[c][1]benzazepin-5-yl)acetyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C27H31N3O6 MolecularWeight: 493.55154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C2=CC=CC=C2C(=O)N(C3=CC=CC=C13)CC(=O)N4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)OC1C2=CC=CC=C2C(=O)N(C3=CC=CC=C13)CC(=O)N4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H31N3O6/c1-18(31)35-24-19-9-5-6-10-20(19)25(33)30(22-12-8-7-11-21(22)24)17-23(32)28-13-15-29(16-14-28)26(34)36-27(2,3)4/h5-12,24H,13-17H2,1-4H3