[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino] 4-methoxybenzoate

Systemtic Name: [[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino] 4-methoxybenzoate Openeye Name: [(1-benzylpiperidin-1-ium-4-ylidene)amino] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [[1-(phenylmethyl)-4-piperidin-1-iumylidene]amino] ester IUPAC Name: [(1-benzylpiperidin-1-ium-4-ylidene)amino] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [(1-benzylpiperidin-1-ium-4-ylidene)amino] ester Formula: C20H23N2O3+ MolecularWeight: 339.40822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)ON=C2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)ON=C2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O3/c1-24-19-9-7-17(8-10-19)20(23)25-21-18-11-13-22(14-12-18)15-16-5-3-2-4-6-16/h2-10H,11-15H2,1H3/p+1