[3-oxidanylidene-3-(pentylamino)-2-piperidin-1-yl-propyl] 2-phenylethanoate

Systemtic Name: [3-oxidanylidene-3-(pentylamino)-2-piperidin-1-yl-propyl] 2-phenylethanoate Openeye Name: [3-oxo-3-(pentylamino)-2-(1-piperidyl)propyl] 2-phenylacetate CAS Name: 2-phenylacetic acid [3-oxo-3-(pentylamino)-2-(1-piperidinyl)propyl] ester IUPAC Name: [3-oxo-3-(pentylamino)-2-piperidin-1-ylpropyl] 2-phenylacetate Traditional Name: 2-phenylacetic acid [3-(amylamino)-3-keto-2-piperidino-propyl] ester Formula: C21H32N2O3 MolecularWeight: 360.49038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(COC(=O)CC1=CC=CC=C1)N2CCCCC2

Isomeric SMILES

CCCCCNC(=O)C(COC(=O)CC1=CC=CC=C1)N2CCCCC2

InChI

InChI=1S/C21H32N2O3/c1-2-3-8-13-22-21(25)19(23-14-9-5-10-15-23)17-26-20(24)16-18-11-6-4-7-12-18/h4,6-7,11-12,19H,2-3,5,8-10,13-17H2,1H3,(H,22,25)