dimethyl (Z)-2-[(3-methoxy-4-oxidanyl-5-oxidanylidene-cyclohepta-1,3,6-trien-1-yl)amino]but-2-enedioate

Systemtic Name: dimethyl (Z)-2-[(3-methoxy-4-oxidanyl-5-oxidanylidene-cyclohepta-1,3,6-trien-1-yl)amino]but-2-enedioate Openeye Name: dimethyl (Z)-2-[(4-hydroxy-3-methoxy-5-oxo-cyclohepta-1,3,6-trien-1-yl)amino]but-2-enedioate CAS Name: (Z)-2-[(4-hydroxy-3-methoxy-5-oxo-1-cyclohepta-1,3,6-trienyl)amino]-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (Z)-2-[(4-hydroxy-3-methoxy-5-oxocyclohepta-1,3,6-trien-1-yl)amino]but-2-enedioate Traditional Name: (Z)-2-[(4-hydroxy-5-keto-3-methoxy-cyclohepta-1,3,6-trien-1-yl)amino]but-2-enedioic acid dimethyl ester Formula: C14H15NO7 MolecularWeight: 309.2714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)C=CC(=C1)NC(=CC(=O)OC)C(=O)OC)O

Isomeric SMILES

COC1=C(C(=O)C=CC(=C1)N/C(=C\C(=O)OC)/C(=O)OC)O

InChI

InChI=1S/C14H15NO7/c1-20-11-6-8(4-5-10(16)13(11)18)15-9(14(19)22-3)7-12(17)21-2/h4-7,15H,1-3H3,(H,16,18)/b9-7-