ethyl 4-[2-(11-acetamido-6H-benzo[c][1]benzoxepin-11-yl)ethyl]benzoate

Systemtic Name: ethyl 4-[2-(11-acetamido-6H-benzo[c][1]benzoxepin-11-yl)ethyl]benzoate Openeye Name: ethyl 4-[2-(11-acetamido-6H-benzo[c][1]benzoxepin-11-yl)ethyl]benzoate CAS Name: 4-[2-(11-acetamido-6H-benzo[c][1]benzoxepin-11-yl)ethyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(11-acetamido-6H-benzo[c][1]benzoxepin-11-yl)ethyl]benzoate Traditional Name: 4-[2-(11-acetamido-6H-benzo[c][1]benzoxepin-11-yl)ethyl]benzoic acid ethyl ester Formula: C27H27NO4 MolecularWeight: 429.50758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CCC2(C3=CC=CC=C3COC4=CC=CC=C42)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CCC2(C3=CC=CC=C3COC4=CC=CC=C42)NC(=O)C

InChI

InChI=1S/C27H27NO4/c1-3-31-26(30)21-14-12-20(13-15-21)16-17-27(28-19(2)29)23-9-5-4-8-22(23)18-32-25-11-7-6-10-24(25)27/h4-15H,3,16-18H2,1-2H3,(H,28,29)