ethyl 5-[(2-nitrophenyl)amino]-1-(phenylmethyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(2-nitrophenyl)amino]-1-(phenylmethyl)pyrazole-4-carboxylate Openeye Name: ethyl 1-benzyl-5-(2-nitroanilino)pyrazole-4-carboxylate CAS Name: 5-(2-nitroanilino)-1-(phenylmethyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-5-(2-nitroanilino)pyrazole-4-carboxylate Traditional Name: 1-benzyl-5-(2-nitroanilino)pyrazole-4-carboxylic acid ethyl ester Formula: C19H18N4O4 MolecularWeight: 366.37062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)CC2=CC=CC=C2)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)CC2=CC=CC=C2)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O4/c1-2-27-19(24)15-12-20-22(13-14-8-4-3-5-9-14)18(15)21-16-10-6-7-11-17(16)23(25)26/h3-12,21H,2,13H2,1H3