ethyl 3-[furan-2-ylmethyl-(4-methylphenyl)carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[furan-2-ylmethyl-(4-methylphenyl)carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[2-furylmethyl(p-tolyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[N-(2-furanylmethyl)-4-methylanilino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[furan-2-ylmethyl-(4-methylphenyl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[2-furfuryl(p-tolyl)carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C22H20N2O6 MolecularWeight: 408.404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20N2O6/c1-3-29-22(26)17-11-16(12-19(13-17)24(27)28)21(25)23(14-20-5-4-10-30-20)18-8-6-15(2)7-9-18/h4-13H,3,14H2,1-2H3