ethyl 3-[(4-ethoxyphenyl)carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[(4-ethoxyphenyl)carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[(4-ethoxyphenyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[(4-ethoxyanilino)-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[(4-ethoxyphenyl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-nitro-5-(p-phenetylcarbamoyl)benzoic acid ethyl ester Formula: C18H18N2O6 MolecularWeight: 358.34532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C18H18N2O6/c1-3-25-16-7-5-14(6-8-16)19-17(21)12-9-13(18(22)26-4-2)11-15(10-12)20(23)24/h5-11H,3-4H2,1-2H3,(H,19,21)