methyl 2-methylidene-3-[(4-nitrophenyl)carbonyl-oxidanyl-amino]butanoate

Systemtic Name: methyl 2-methylidene-3-[(4-nitrophenyl)carbonyl-oxidanyl-amino]butanoate Openeye Name: methyl 3-[hydroxy-(4-nitrobenzoyl)amino]-2-methylene-butanoate CAS Name: 3-[hydroxy-[(4-nitrophenyl)-oxomethyl]amino]-2-methylenebutanoic acid methyl ester IUPAC Name: methyl 3-[hydroxy-(4-nitrobenzoyl)amino]-2-methylidenebutanoate Traditional Name: 2-[1-[hydroxy-(4-nitrobenzoyl)amino]ethyl]acrylic acid methyl ester Formula: C13H14N2O6 MolecularWeight: 294.26006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O6/c1-8(13(17)21-3)9(2)14(18)12(16)10-4-6-11(7-5-10)15(19)20/h4-7,9,18H,1H2,2-3H3