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

Systemtic Name: methyl 2-[1-(3-chlorophenyl)-3-methyl-5-(2-nitrophenyl)pyrazol-4-yl]ethanoate Openeye Name: methyl 2-[1-(3-chlorophenyl)-3-methyl-5-(2-nitrophenyl)pyrazol-4-yl]acetate CAS Name: 2-[1-(3-chlorophenyl)-3-methyl-5-(2-nitrophenyl)-4-pyrazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-(3-chlorophenyl)-3-methyl-5-(2-nitrophenyl)pyrazol-4-yl]acetate Traditional Name: 2-[1-(3-chlorophenyl)-3-methyl-5-(2-nitrophenyl)pyrazol-4-yl]acetic acid methyl ester Formula: C19H16ClN3O4 MolecularWeight: 385.80104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CC(=O)OC)C2=CC=CC=C2[N+](=O)[O-])C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=NN(C(=C1CC(=O)OC)C2=CC=CC=C2[N+](=O)[O-])C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H16ClN3O4/c1-12-16(11-18(24)27-2)19(15-8-3-4-9-17(15)23(25)26)22(21-12)14-7-5-6-13(20)10-14/h3-10H,11H2,1-2H3