[2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-(furan-2-ylcarbonylamino)propanoate

Systemtic Name: [2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-(furan-2-ylcarbonylamino)propanoate Openeye Name: [2-(4-chloro-3-nitro-anilino)-2-oxo-1-phenyl-ethyl] 2-(furan-2-carbonylamino)propanoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]propanoic acid [2-(4-chloro-3-nitroanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(4-chloro-3-nitroanilino)-2-oxo-1-phenylethyl] 2-(furan-2-carbonylamino)propanoate Traditional Name: 2-(2-furoylamino)propionic acid [2-(4-chloro-3-nitro-anilino)-2-keto-1-phenyl-ethyl] ester Formula: C22H18ClN3O7 MolecularWeight: 471.84722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])NC(=O)C3=CC=CO3

Isomeric SMILES

CC(C(=O)OC(C1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])NC(=O)C3=CC=CO3

InChI

InChI=1S/C22H18ClN3O7/c1-13(24-20(27)18-8-5-11-32-18)22(29)33-19(14-6-3-2-4-7-14)21(28)25-15-9-10-16(23)17(12-15)26(30)31/h2-13,19H,1H3,(H,24,27)(H,25,28)