methyl 3-[(4-methoxyphenyl)methylcarbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[(4-methoxyphenyl)methylcarbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(4-methoxyphenyl)methylcarbamoyl]-5-nitro-benzoate CAS Name: 3-[[(4-methoxyphenyl)methylamino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(4-methoxyphenyl)methylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-nitro-5-(p-anisylcarbamoyl)benzoic acid methyl ester Formula: C17H16N2O6 MolecularWeight: 344.31874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C17H16N2O6/c1-24-15-5-3-11(4-6-15)10-18-16(20)12-7-13(17(21)25-2)9-14(8-12)19(22)23/h3-9H,10H2,1-2H3,(H,18,20)