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

Systemtic Name: ethyl 3-[[2-(furan-2-ylmethylcarbamoyl)phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[2-(2-furylmethylcarbamoyl)phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[2-[(2-furanylmethylamino)-oxomethyl]anilino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(furan-2-ylmethylcarbamoyl)phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[2-(2-furfurylcarbamoyl)phenyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C22H19N3O7 MolecularWeight: 437.40216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O7/c1-2-31-22(28)15-10-14(11-16(12-15)25(29)30)20(26)24-19-8-4-3-7-18(19)21(27)23-13-17-6-5-9-32-17/h3-12H,2,13H2,1H3,(H,23,27)(H,24,26)