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4-[(3-ethoxycarbonyl-5-nitro-phenyl)carbonylamino]-3-methyl-benzoic acid

4-[(3-ethoxycarbonyl-5-nitro-phenyl)carbonylamino]-3-methyl-benzoic acid

Systemtic Name:4-[(3-ethoxycarbonyl-5-nitro-phenyl)carbonylamino]-3-methyl-benzoic acid
Openeye Name:4-[(3-ethoxycarbonyl-5-nitro-benzoyl)amino]-3-methyl-benzoic acid
CAS Name:4-[[(3-ethoxycarbonyl-5-nitrophenyl)-oxomethyl]amino]-3-methylbenzoic acid
IUPAC Name:4-[(3-ethoxycarbonyl-5-nitrobenzoyl)amino]-3-methylbenzoic acid
Traditional Name:4-[(3-carbethoxy-5-nitro-benzoyl)amino]-3-methyl-benzoic acid
Formula: C18H16N2O7
MolecularWeight: 372.32884
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=C(C=C(C=C2)C(=O)O)C)[N+](=O)[O-]


Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=C(C=C(C=C2)C(=O)O)C)[N+](=O)[O-]


InChI

InChI=1S/C18H16N2O7/c1-3-27-18(24)13-7-12(8-14(9-13)20(25)26)16(21)19-15-5-4-11(17(22)23)6-10(15)2/h4-9H,3H2,1-2H3,(H,19,21)(H,22,23)


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