methyl 2-[3-methyl-1-(3-methylphenyl)-5-(2-nitrophenyl)pyrazol-4-yl]ethanoate

Systemtic Name: methyl 2-[3-methyl-1-(3-methylphenyl)-5-(2-nitrophenyl)pyrazol-4-yl]ethanoate Openeye Name: methyl 2-[3-methyl-1-(m-tolyl)-5-(2-nitrophenyl)pyrazol-4-yl]acetate CAS Name: 2-[3-methyl-1-(3-methylphenyl)-5-(2-nitrophenyl)-4-pyrazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-methyl-1-(3-methylphenyl)-5-(2-nitrophenyl)pyrazol-4-yl]acetate Traditional Name: 2-[3-methyl-1-(m-tolyl)-5-(2-nitrophenyl)pyrazol-4-yl]acetic acid methyl ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C(=N2)C)CC(=O)OC)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C(=N2)C)CC(=O)OC)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O4/c1-13-7-6-8-15(11-13)22-20(16-9-4-5-10-18(16)23(25)26)17(14(2)21-22)12-19(24)27-3/h4-11H,12H2,1-3H3