[1-[bis(2-methylpropyl)amino]-3-piperidin-1-yl-propan-2-yl] benzoate

Systemtic Name: [1-[bis(2-methylpropyl)amino]-3-piperidin-1-yl-propan-2-yl] benzoate Openeye Name: [1-[(diisobutylamino)methyl]-2-(1-piperidyl)ethyl] benzoate CAS Name: benzoic acid [1-[bis(2-methylpropyl)amino]-3-(1-piperidinyl)propan-2-yl] ester IUPAC Name: [1-[bis(2-methylpropyl)amino]-3-piperidin-1-ylpropan-2-yl] benzoate Traditional Name: benzoic acid [1-[(diisobutylamino)methyl]-2-piperidino-ethyl] ester Formula: C23H38N2O2 MolecularWeight: 374.56002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)CC(CN1CCCCC1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)CN(CC(C)C)CC(CN1CCCCC1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C23H38N2O2/c1-19(2)15-25(16-20(3)4)18-22(17-24-13-9-6-10-14-24)27-23(26)21-11-7-5-8-12-21/h5,7-8,11-12,19-20,22H,6,9-10,13-18H2,1-4H3