methyl 4-[[(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[oxo-(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carbonyl)amino]methyl]benzoic acid methyl ester Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=NN(C3=C2CCC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=NN(C3=C2CCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O3/c1-28-22(27)16-12-10-15(11-13-16)14-23-21(26)20-18-8-5-9-19(18)25(24-20)17-6-3-2-4-7-17/h2-4,6-7,10-13H,5,8-9,14H2,1H3,(H,23,26)