methyl 3-[cyclopropyl-[(4-fluorophenyl)methyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[cyclopropyl-[(4-fluorophenyl)methyl]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[cyclopropyl-[(4-fluorophenyl)methyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[cyclopropyl-[(4-fluorophenyl)methyl]amino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[cyclopropyl-[(4-fluorophenyl)methyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[cyclopropyl-(4-fluorobenzyl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C19H17FN2O5 MolecularWeight: 372.347083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17FN2O5/c1-27-19(24)14-8-13(9-17(10-14)22(25)26)18(23)21(16-6-7-16)11-12-2-4-15(20)5-3-12/h2-5,8-10,16H,6-7,11H2,1H3