2-[4-(3-benzo[b][1]benzazepin-11-ylpropyl)piperazin-1-yl]ethyl ethanoate

Systemtic Name: 2-[4-(3-benzo[b][1]benzazepin-11-ylpropyl)piperazin-1-yl]ethyl ethanoate Openeye Name: 2-[4-(3-benzo[b][1]benzazepin-11-ylpropyl)piperazin-1-yl]ethyl acetate CAS Name: acetic acid 2-[4-[3-(11-benzo[b][1]benzazepinyl)propyl]-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-(3-benzo[b][1]benzazepin-11-ylpropyl)piperazin-1-yl]ethyl acetate Traditional Name: acetic acid 2-[4-(3-benzo[b][1]benzazepin-11-ylpropyl)piperazino]ethyl ester Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN1CCN(CC1)CCCN2C3=CC=CC=C3C=CC4=CC=CC=C42

Isomeric SMILES

CC(=O)OCCN1CCN(CC1)CCCN2C3=CC=CC=C3C=CC4=CC=CC=C42

InChI

InChI=1S/C25H31N3O2/c1-21(29)30-20-19-27-17-15-26(16-18-27)13-6-14-28-24-9-4-2-7-22(24)11-12-23-8-3-5-10-25(23)28/h2-5,7-12H,6,13-20H2,1H3