2-methoxy-N-[1-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]ethyl]-5-nitro-benzamide

Systemtic Name: 2-methoxy-N-[1-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]ethyl]-5-nitro-benzamide Openeye Name: 2-methoxy-N-[1-[5-methyl-1-(p-tolyl)pyrazol-4-yl]ethyl]-5-nitro-benzamide CAS Name: 2-methoxy-N-[1-[5-methyl-1-(4-methylphenyl)-4-pyrazolyl]ethyl]-5-nitrobenzamide IUPAC Name: 2-methoxy-N-[1-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]ethyl]-5-nitrobenzamide Traditional Name: 2-methoxy-N-[1-[5-methyl-1-(p-tolyl)pyrazol-4-yl]ethyl]-5-nitro-benzamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O4/c1-13-5-7-16(8-6-13)24-15(3)19(12-22-24)14(2)23-21(26)18-11-17(25(27)28)9-10-20(18)29-4/h5-12,14H,1-4H3,(H,23,26)