N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-2-methyl-3-nitro-benzamide Openeye Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-2-methyl-3-nitro-benzamide CAS Name: N-[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-2-methyl-3-nitrobenzamide Traditional Name: N-[2-(4-ethylbenzyl)pyrazol-3-yl]-2-methyl-3-nitro-benzamide Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H20N4O3/c1-3-15-7-9-16(10-8-15)13-23-19(11-12-21-23)22-20(25)17-5-4-6-18(14(17)2)24(26)27/h4-12H,3,13H2,1-2H3,(H,22,25)