sodium (E)-methoxy-[1-[2-(4-methoxyphenyl)ethyl]-4-oxidanylidene-piperidin-3-ylidene]methanolate

Systemtic Name: sodium (E)-methoxy-[1-[2-(4-methoxyphenyl)ethyl]-4-oxidanylidene-piperidin-3-ylidene]methanolate Openeye Name: sodium (E)-methoxy-[1-[2-(4-methoxyphenyl)ethyl]-4-oxo-3-piperidylidene]methanolate CAS Name: sodium (E)-methoxy-[1-[2-(4-methoxyphenyl)ethyl]-4-oxo-3-piperidinylidene]methanolate IUPAC Name: sodium (E)-methoxy-[1-[2-(4-methoxyphenyl)ethyl]-4-oxopiperidin-3-ylidene]methanolate Traditional Name: sodium (E)-[4-keto-1-[2-(4-methoxyphenyl)ethyl]-3-piperidylidene]-methoxy-methanolate Formula: C16H20NNaO4 MolecularWeight: 313.32407

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCN2CCC(=O)C(=C([O-])OC)C2.[Na+]

Isomeric SMILES

COC1=CC=C(C=C1)CCN2CCC(=O)/C(=C(\[O-])/OC)/C2.[Na+]

InChI

InChI=1S/C16H21NO4.Na/c1-20-13-5-3-12(4-6-13)7-9-17-10-8-15(18)14(11-17)16(19)21-2;/h3-6,19H,7-11H2,1-2H3;/q;+1/p-1/b16-14+;