methyl 3-[cyclopropyl-(phenylmethyl)carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[cyclopropyl-(phenylmethyl)carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[benzyl(cyclopropyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[cyclopropyl-(phenylmethyl)amino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[benzyl(cyclopropyl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[benzyl(cyclopropyl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C19H18N2O5 MolecularWeight: 354.35662

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)N(CC2=CC=CC=C2)C3CC3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)N(CC2=CC=CC=C2)C3CC3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O5/c1-26-19(23)15-9-14(10-17(11-15)21(24)25)18(22)20(16-7-8-16)12-13-5-3-2-4-6-13/h2-6,9-11,16H,7-8,12H2,1H3