N-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-N-(3-ethoxypropyl)benzo[b][1]benzoxepine-5-carboxamide

Systemtic Name: N-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-N-(3-ethoxypropyl)benzo[b][1]benzoxepine-5-carboxamide Openeye Name: N-[2-(cyclopentylamino)-2-oxo-ethyl]-N-(3-ethoxypropyl)benzo[b][1]benzoxepine-5-carboxamide CAS Name: N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-ethoxypropyl)-5-benzo[b][1]benzoxepincarboxamide IUPAC Name: N-[2-(cyclopentylamino)-2-oxoethyl]-N-(3-ethoxypropyl)benzo[b][1]benzoxepine-5-carboxamide Traditional Name: N-[2-(cyclopentylamino)-2-keto-ethyl]-N-(3-ethoxypropyl)benzo[b][1]benzoxepin-5-carboxamide Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN(CC(=O)NC1CCCC1)C(=O)C2=CC3=CC=CC=C3OC4=CC=CC=C42

Isomeric SMILES

CCOCCCN(CC(=O)NC1CCCC1)C(=O)C2=CC3=CC=CC=C3OC4=CC=CC=C42

InChI

InChI=1S/C27H32N2O4/c1-2-32-17-9-16-29(19-26(30)28-21-11-4-5-12-21)27(31)23-18-20-10-3-7-14-24(20)33-25-15-8-6-13-22(23)25/h3,6-8,10,13-15,18,21H,2,4-5,9,11-12,16-17,19H2,1H3,(H,28,30)