5-[[[4-(dimethylamino)-3-nitro-phenyl]carbonylamino]methyl]-2-methoxy-benzoic acid

Systemtic Name: 5-[[[4-(dimethylamino)-3-nitro-phenyl]carbonylamino]methyl]-2-methoxy-benzoic acid Openeye Name: 5-[[[4-(dimethylamino)-3-nitro-benzoyl]amino]methyl]-2-methoxy-benzoic acid CAS Name: 5-[[[[4-(dimethylamino)-3-nitrophenyl]-oxomethyl]amino]methyl]-2-methoxybenzoic acid IUPAC Name: 5-[[[4-(dimethylamino)-3-nitrobenzoyl]amino]methyl]-2-methoxybenzoic acid Traditional Name: 5-[[[4-(dimethylamino)-3-nitro-benzoyl]amino]methyl]-2-methoxy-benzoic acid Formula: C18H19N3O6 MolecularWeight: 373.35996

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)NCC2=CC(=C(C=C2)OC)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)NCC2=CC(=C(C=C2)OC)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O6/c1-20(2)14-6-5-12(9-15(14)21(25)26)17(22)19-10-11-4-7-16(27-3)13(8-11)18(23)24/h4-9H,10H2,1-3H3,(H,19,22)(H,23,24)