[(2S)-3-phenyl-2-piperidin-1-yl-propyl] 4-azanyl-3-propoxy-benzoate

Systemtic Name: [(2S)-3-phenyl-2-piperidin-1-yl-propyl] 4-azanyl-3-propoxy-benzoate Openeye Name: [(2S)-3-phenyl-2-(1-piperidyl)propyl] 4-amino-3-propoxy-benzoate CAS Name: 4-amino-3-propoxybenzoic acid [(2S)-3-phenyl-2-(1-piperidinyl)propyl] ester IUPAC Name: [(2S)-3-phenyl-2-piperidin-1-ylpropyl] 4-amino-3-propoxybenzoate Traditional Name: 4-amino-3-propoxy-benzoic acid [(2S)-3-phenyl-2-piperidino-propyl] ester Formula: C24H32N2O3 MolecularWeight: 396.52248

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)C(=O)OCC(CC2=CC=CC=C2)N3CCCCC3)N

Isomeric SMILES

CCCOC1=C(C=CC(=C1)C(=O)OC[C@H](CC2=CC=CC=C2)N3CCCCC3)N

InChI

InChI=1S/C24H32N2O3/c1-2-15-28-23-17-20(11-12-22(23)25)24(27)29-18-21(26-13-7-4-8-14-26)16-19-9-5-3-6-10-19/h3,5-6,9-12,17,21H,2,4,7-8,13-16,18,25H2,1H3/t21-/m0/s1