ethyl 3-[furan-2-ylmethyl(phenyl)carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[furan-2-ylmethyl(phenyl)carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[2-furylmethyl(phenyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[N-(2-furanylmethyl)anilino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[furan-2-ylmethyl(phenyl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[2-furfuryl(phenyl)carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C21H18N2O6 MolecularWeight: 394.37742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N(CC2=CC=CO2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N(CC2=CC=CO2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O6/c1-2-28-21(25)16-11-15(12-18(13-16)23(26)27)20(24)22(14-19-9-6-10-29-19)17-7-4-3-5-8-17/h3-13H,2,14H2,1H3