[(1-methylpiperidin-1-ium-4-ylidene)amino] 4-propoxybenzoate

Systemtic Name: [(1-methylpiperidin-1-ium-4-ylidene)amino] 4-propoxybenzoate Openeye Name: [(1-methylpiperidin-1-ium-4-ylidene)amino] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [(1-methyl-4-piperidin-1-iumylidene)amino] ester IUPAC Name: [(1-methylpiperidin-1-ium-4-ylidene)amino] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [(1-methylpiperidin-1-ium-4-ylidene)amino] ester Formula: C16H23N2O3+ MolecularWeight: 291.36542

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)ON=C2CC[NH+](CC2)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)ON=C2CC[NH+](CC2)C

InChI

InChI=1S/C16H22N2O3/c1-3-12-20-15-6-4-13(5-7-15)16(19)21-17-14-8-10-18(2)11-9-14/h4-7H,3,8-12H2,1-2H3/p+1