4-(3-azanyl-2-methyl-3-oxidanylidene-propoxy)-5-methoxy-2-nitro-benzoic acid

Systemtic Name: 4-(3-azanyl-2-methyl-3-oxidanylidene-propoxy)-5-methoxy-2-nitro-benzoic acid Openeye Name: 4-(3-amino-2-methyl-3-oxo-propoxy)-5-methoxy-2-nitro-benzoic acid CAS Name: 4-(3-amino-2-methyl-3-oxopropoxy)-5-methoxy-2-nitrobenzoic acid IUPAC Name: 4-(3-amino-2-methyl-3-oxopropoxy)-5-methoxy-2-nitrobenzoic acid Traditional Name: 4-(3-amino-3-keto-2-methyl-propoxy)-5-methoxy-2-nitro-benzoic acid Formula: C12H14N2O7 MolecularWeight: 298.24876

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)O)OC)C(=O)N

Isomeric SMILES

CC(COC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)O)OC)C(=O)N

InChI

InChI=1S/C12H14N2O7/c1-6(11(13)15)5-21-10-4-8(14(18)19)7(12(16)17)3-9(10)20-2/h3-4,6H,5H2,1-2H3,(H2,13,15)(H,16,17)