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

Systemtic Name: methyl 3-[[4-(ethoxymethyl)phenyl]methylcarbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[[4-(ethoxymethyl)phenyl]methylcarbamoyl]-5-nitro-benzoate CAS Name: 3-[[[4-(ethoxymethyl)phenyl]methylamino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[4-(ethoxymethyl)phenyl]methylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[[4-(ethoxymethyl)benzyl]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C19H20N2O6 MolecularWeight: 372.3719

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=CC=C(C=C1)CNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CCOCC1=CC=C(C=C1)CNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C19H20N2O6/c1-3-27-12-14-6-4-13(5-7-14)11-20-18(22)15-8-16(19(23)26-2)10-17(9-15)21(24)25/h4-10H,3,11-12H2,1-2H3,(H,20,22)