methyl (Z)-2-[(2-nitrophenyl)-oxidanyl-methyl]but-2-enoate

Systemtic Name: methyl (Z)-2-[(2-nitrophenyl)-oxidanyl-methyl]but-2-enoate Openeye Name: methyl (Z)-2-[hydroxy-(2-nitrophenyl)methyl]but-2-enoate CAS Name: (Z)-2-[hydroxy-(2-nitrophenyl)methyl]-2-butenoic acid methyl ester IUPAC Name: methyl (Z)-2-[hydroxy-(2-nitrophenyl)methyl]but-2-enoate Traditional Name: (Z)-2-[hydroxy-(2-nitrophenyl)methyl]but-2-enoic acid methyl ester Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO5/c1-3-8(12(15)18-2)11(14)9-6-4-5-7-10(9)13(16)17/h3-7,11,14H,1-2H3/b8-3-