ethyl 1-[(4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-3-yl)carbonyl]-3-(3-phenylpropyl)piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-3-yl)carbonyl]-3-(3-phenylpropyl)piperidine-3-carboxylate Openeye Name: ethyl 1-(4-oxo-6,7-dihydro-5H-benzofuran-3-carbonyl)-3-(3-phenylpropyl)piperidine-3-carboxylate CAS Name: 1-[oxo-(4-oxo-6,7-dihydro-5H-benzofuran-3-yl)methyl]-3-(3-phenylpropyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-oxo-6,7-dihydro-5H-1-benzofuran-3-carbonyl)-3-(3-phenylpropyl)piperidine-3-carboxylate Traditional Name: 1-(4-keto-6,7-dihydro-5H-benzofuran-3-carbonyl)-3-(3-phenylpropyl)nipecotic acid ethyl ester Formula: C26H31NO5 MolecularWeight: 437.52804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C2=COC3=C2C(=O)CCC3)CCCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)C2=COC3=C2C(=O)CCC3)CCCC4=CC=CC=C4

InChI

InChI=1S/C26H31NO5/c1-2-31-25(30)26(14-7-11-19-9-4-3-5-10-19)15-8-16-27(18-26)24(29)20-17-32-22-13-6-12-21(28)23(20)22/h3-5,9-10,17H,2,6-8,11-16,18H2,1H3