ethanoic acid; 3-(2-methylpiperidin-1-yl)propyl benzoate

Systemtic Name: ethanoic acid; 3-(2-methylpiperidin-1-yl)propyl benzoate Openeye Name: acetic acid; 3-(2-methyl-1-piperidyl)propyl benzoate CAS Name: acetic acid; benzoic acid 3-(2-methyl-1-piperidinyl)propyl ester IUPAC Name: acetic acid; 3-(2-methylpiperidin-1-yl)propyl benzoate Traditional Name: acetic acid; benzoic acid 3-(2-methylpiperidino)propyl ester Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCOC(=O)C2=CC=CC=C2.CC(=O)O

Isomeric SMILES

CC1CCCCN1CCCOC(=O)C2=CC=CC=C2.CC(=O)O

InChI

InChI=1S/C16H23NO2.C2H4O2/c1-14-8-5-6-11-17(14)12-7-13-19-16(18)15-9-3-2-4-10-15;1-2(3)4/h2-4,9-10,14H,5-8,11-13H2,1H3;1H3,(H,3,4)