[(2S)-2-piperidin-1-ylpropyl] 4-azanyl-3-propoxy-benzoate

Systemtic Name: [(2S)-2-piperidin-1-ylpropyl] 4-azanyl-3-propoxy-benzoate Openeye Name: [(2S)-2-(1-piperidyl)propyl] 4-amino-3-propoxy-benzoate CAS Name: 4-amino-3-propoxybenzoic acid [(2S)-2-(1-piperidinyl)propyl] ester IUPAC Name: [(2S)-2-piperidin-1-ylpropyl] 4-amino-3-propoxybenzoate Traditional Name: 4-amino-3-propoxy-benzoic acid [(2S)-2-piperidinopropyl] ester Formula: C18H28N2O3 MolecularWeight: 320.42652

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)C(=O)OCC(C)N2CCCCC2)N

Isomeric SMILES

CCCOC1=C(C=CC(=C1)C(=O)OC[C@H](C)N2CCCCC2)N

InChI

InChI=1S/C18H28N2O3/c1-3-11-22-17-12-15(7-8-16(17)19)18(21)23-13-14(2)20-9-5-4-6-10-20/h7-8,12,14H,3-6,9-11,13,19H2,1-2H3/t14-/m0/s1