3-[(3-methoxy-3-oxidanylidene-propanoyl)amino]-5-nitro-benzoic acid

Systemtic Name: 3-[(3-methoxy-3-oxidanylidene-propanoyl)amino]-5-nitro-benzoic acid Openeye Name: 3-[(3-methoxy-3-oxo-propanoyl)amino]-5-nitro-benzoic acid CAS Name: 3-[(3-methoxy-1,3-dioxopropyl)amino]-5-nitrobenzoic acid IUPAC Name: 3-[(3-methoxy-3-oxopropanoyl)amino]-5-nitrobenzoic acid Traditional Name: 3-[(3-keto-3-methoxy-propanoyl)amino]-5-nitro-benzoic acid Formula: C11H10N2O7 MolecularWeight: 282.2063

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)NC1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CC(=O)NC1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H10N2O7/c1-20-10(15)5-9(14)12-7-2-6(11(16)17)3-8(4-7)13(18)19/h2-4H,5H2,1H3,(H,12,14)(H,16,17)