N-[1-(4-chlorophenyl)-2-methyl-propyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-[1-(4-chlorophenyl)-2-methyl-propyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[1-(4-chlorophenyl)-2-methyl-propyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[1-(4-chlorophenyl)-2-methylpropyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[1-(4-chlorophenyl)-2-methylpropyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[1-(4-chlorophenyl)-2-methyl-propyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C19H18ClN5O3 MolecularWeight: 399.83092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)Cl)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C1=CC=C(C=C1)Cl)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H18ClN5O3/c1-12(2)18(13-3-6-15(20)7-4-13)23-19(26)14-5-8-16(17(9-14)25(27)28)24-11-21-10-22-24/h3-12,18H,1-2H3,(H,23,26)