N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-4-methoxy-3-nitro-benzamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-4-methoxy-3-nitro-benzamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-pyrazolyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[1-(4-chlorobenzyl)pyrazol-4-yl]-4-methoxy-3-nitro-benzamide Formula: C18H15ClN4O4 MolecularWeight: 386.7891

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CN(N=C2)CC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CN(N=C2)CC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H15ClN4O4/c1-27-17-7-4-13(8-16(17)23(25)26)18(24)21-15-9-20-22(11-15)10-12-2-5-14(19)6-3-12/h2-9,11H,10H2,1H3,(H,21,24)