methyl 3-nitro-5-[(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)carbamoyl]benzoate

Systemtic Name: methyl 3-nitro-5-[(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)carbamoyl]benzoate Openeye Name: methyl 3-nitro-5-[(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)carbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-5-[(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)carbamoyl]benzoate Traditional Name: 3-nitro-5-[(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)carbamoyl]benzoic acid methyl ester Formula: C21H18N4O5 MolecularWeight: 406.39142

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)NC2=C3CCCC3=NN2C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)NC2=C3CCCC3=NN2C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O5/c1-30-21(27)14-10-13(11-16(12-14)25(28)29)20(26)22-19-17-8-5-9-18(17)23-24(19)15-6-3-2-4-7-15/h2-4,6-7,10-12H,5,8-9H2,1H3,(H,22,26)