[5-oxidanylidene-6-[(4-oxidanyl-4-phenyl-piperidin-1-yl)methyl]-7,8-dihydro-6H-naphthalen-2-yl] butanoate

Systemtic Name: [5-oxidanylidene-6-[(4-oxidanyl-4-phenyl-piperidin-1-yl)methyl]-7,8-dihydro-6H-naphthalen-2-yl] butanoate Openeye Name: [2-[(4-hydroxy-4-phenyl-1-piperidyl)methyl]-1-oxo-tetralin-6-yl] butanoate CAS Name: butanoic acid [6-[(4-hydroxy-4-phenyl-1-piperidinyl)methyl]-5-oxo-7,8-dihydro-6H-naphthalen-2-yl] ester IUPAC Name: [6-[(4-hydroxy-4-phenylpiperidin-1-yl)methyl]-5-oxo-7,8-dihydro-6H-naphthalen-2-yl] butanoate Traditional Name: butyric acid [2-[(4-hydroxy-4-phenyl-piperidino)methyl]-1-keto-tetralin-6-yl] ester Formula: C26H31NO4 MolecularWeight: 421.52864

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC2=C(C=C1)C(=O)C(CC2)CN3CCC(CC3)(C4=CC=CC=C4)O

Isomeric SMILES

CCCC(=O)OC1=CC2=C(C=C1)C(=O)C(CC2)CN3CCC(CC3)(C4=CC=CC=C4)O

InChI

InChI=1S/C26H31NO4/c1-2-6-24(28)31-22-11-12-23-19(17-22)9-10-20(25(23)29)18-27-15-13-26(30,14-16-27)21-7-4-3-5-8-21/h3-5,7-8,11-12,17,20,30H,2,6,9-10,13-16,18H2,1H3