sodium 2-methoxy-4-[(E)-3-[(4-methoxycarbonylcyclohexyl)amino]-3-oxidanylidene-prop-1-enyl]phenolate

Systemtic Name: sodium 2-methoxy-4-[(E)-3-[(4-methoxycarbonylcyclohexyl)amino]-3-oxidanylidene-prop-1-enyl]phenolate Openeye Name: sodium 2-methoxy-4-[(E)-3-[(4-methoxycarbonylcyclohexyl)amino]-3-oxo-prop-1-enyl]phenolate CAS Name: sodium 2-methoxy-4-[(E)-3-[(4-methoxycarbonylcyclohexyl)amino]-3-oxoprop-1-enyl]phenolate IUPAC Name: sodium 2-methoxy-4-[(E)-3-[(4-methoxycarbonylcyclohexyl)amino]-3-oxoprop-1-enyl]phenolate Traditional Name: sodium 4-[(E)-3-[(4-carbomethoxycyclohexyl)amino]-3-keto-prop-1-enyl]-2-methoxy-phenolate Formula: C18H22NNaO5 MolecularWeight: 355.36075

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)NC2CCC(CC2)C(=O)OC)[O-].[Na+]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)NC2CCC(CC2)C(=O)OC)[O-].[Na+]

InChI

InChI=1S/C18H23NO5.Na/c1-23-16-11-12(3-9-15(16)20)4-10-17(21)19-14-7-5-13(6-8-14)18(22)24-2;/h3-4,9-11,13-14,20H,5-8H2,1-2H3,(H,19,21);/q;+1/p-1/b10-4+;