3-(3-methylpiperidin-1-yl)propyl 4-butoxybenzoate

Systemtic Name: 3-(3-methylpiperidin-1-yl)propyl 4-butoxybenzoate Openeye Name: 3-(3-methyl-1-piperidyl)propyl 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid 3-(3-methyl-1-piperidinyl)propyl ester IUPAC Name: 3-(3-methylpiperidin-1-yl)propyl 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid 3-(3-methylpiperidino)propyl ester Formula: C20H31NO3 MolecularWeight: 333.46504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCCCN2CCCC(C2)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCCCN2CCCC(C2)C

InChI

InChI=1S/C20H31NO3/c1-3-4-14-23-19-10-8-18(9-11-19)20(22)24-15-6-13-21-12-5-7-17(2)16-21/h8-11,17H,3-7,12-16H2,1-2H3