methyl (Z)-5-(5-methyl-2-nitro-phenyl)-5-oxidanyl-3-oxidanylidene-pent-4-enoate

Systemtic Name: methyl (Z)-5-(5-methyl-2-nitro-phenyl)-5-oxidanyl-3-oxidanylidene-pent-4-enoate Openeye Name: methyl (Z)-5-hydroxy-5-(5-methyl-2-nitro-phenyl)-3-oxo-pent-4-enoate CAS Name: (Z)-5-hydroxy-5-(5-methyl-2-nitrophenyl)-3-oxo-4-pentenoic acid methyl ester IUPAC Name: methyl (Z)-5-hydroxy-5-(5-methyl-2-nitrophenyl)-3-oxopent-4-enoate Traditional Name: (Z)-5-hydroxy-3-keto-5-(5-methyl-2-nitro-phenyl)pent-4-enoic acid methyl ester Formula: C13H13NO6 MolecularWeight: 279.24542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])C(=CC(=O)CC(=O)OC)O

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])/C(=C/C(=O)CC(=O)OC)/O

InChI

InChI=1S/C13H13NO6/c1-8-3-4-11(14(18)19)10(5-8)12(16)6-9(15)7-13(17)20-2/h3-6,16H,7H2,1-2H3/b12-6-