4-ethoxy-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-5-methoxy-2-nitro-benzamide

Systemtic Name: 4-ethoxy-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-5-methoxy-2-nitro-benzamide Openeye Name: 4-ethoxy-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-5-methoxy-2-nitro-benzamide CAS Name: 4-ethoxy-N-[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]-5-methoxy-2-nitrobenzamide IUPAC Name: 4-ethoxy-N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-5-methoxy-2-nitrobenzamide Traditional Name: 4-ethoxy-N-[2-(4-ethylbenzyl)pyrazol-3-yl]-5-methoxy-2-nitro-benzamide Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O5/c1-4-15-6-8-16(9-7-15)14-25-21(10-11-23-25)24-22(27)17-12-19(30-3)20(31-5-2)13-18(17)26(28)29/h6-13H,4-5,14H2,1-3H3,(H,24,27)