sodium 6-methoxycarbonyl-5,5-dimethyl-3-oxidanylidene-2-[(E)-N-prop-2-enoxy-C-propyl-carbonimidoyl]cyclohexen-1-olate

Systemtic Name: sodium 6-methoxycarbonyl-5,5-dimethyl-3-oxidanylidene-2-[(E)-N-prop-2-enoxy-C-propyl-carbonimidoyl]cyclohexen-1-olate Openeye Name: sodium 2-[(E)-N-allyloxy-C-propyl-carbonimidoyl]-6-methoxycarbonyl-5,5-dimethyl-3-oxo-cyclohexen-1-olate CAS Name: sodium 6-methoxycarbonyl-5,5-dimethyl-3-oxo-2-[(1E)-1-prop-2-enoxyiminobutyl]-1-cyclohexenolate IUPAC Name: sodium 6-methoxycarbonyl-5,5-dimethyl-3-oxo-2-[(E)-N-prop-2-enoxy-C-propylcarbonimidoyl]cyclohexen-1-olate Traditional Name: sodium 2-[(E)-N-allyloxy-C-propyl-carbonimidoyl]-6-carbomethoxy-3-keto-5,5-dimethyl-cyclohexen-1-olate Formula: C17H24NNaO5 MolecularWeight: 345.36593

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NOCC=C)C1=C(C(C(CC1=O)(C)C)C(=O)OC)[O-].[Na+]

Isomeric SMILES

CCC/C(=N\OCC=C)/C1=C(C(C(CC1=O)(C)C)C(=O)OC)[O-].[Na+]

InChI

InChI=1S/C17H25NO5.Na/c1-6-8-11(18-23-9-7-2)13-12(19)10-17(3,4)14(15(13)20)16(21)22-5;/h7,14,20H,2,6,8-10H2,1,3-5H3;/q;+1/p-1/b18-11+;