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

Systemtic Name: methyl 3-[(4-dimethylaminophenyl)methylcarbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(4-dimethylaminophenyl)methylcarbamoyl]-5-nitro-benzoate CAS Name: 3-[[(4-dimethylaminophenyl)methylamino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(4-dimethylaminophenyl)methylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[[4-(dimethylamino)benzyl]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O5/c1-20(2)15-6-4-12(5-7-15)11-19-17(22)13-8-14(18(23)26-3)10-16(9-13)21(24)25/h4-10H,11H2,1-3H3,(H,19,22)