2-(3-chlorophenyl)-N-[4-(1-imidazol-1-yl-2-methyl-propyl)-2-nitro-phenyl]ethanamide

Systemtic Name: 2-(3-chlorophenyl)-N-[4-(1-imidazol-1-yl-2-methyl-propyl)-2-nitro-phenyl]ethanamide Openeye Name: 2-(3-chlorophenyl)-N-[4-(1-imidazol-1-yl-2-methyl-propyl)-2-nitro-phenyl]acetamide CAS Name: 2-(3-chlorophenyl)-N-[4-[1-(1-imidazolyl)-2-methylpropyl]-2-nitrophenyl]acetamide IUPAC Name: 2-(3-chlorophenyl)-N-[4-(1-imidazol-1-yl-2-methylpropyl)-2-nitrophenyl]acetamide Traditional Name: 2-(3-chlorophenyl)-N-[4-(1-imidazol-1-yl-2-methyl-propyl)-2-nitro-phenyl]acetamide Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC(=C(C=C1)NC(=O)CC2=CC(=CC=C2)Cl)[N+](=O)[O-])N3C=CN=C3

Isomeric SMILES

CC(C)C(C1=CC(=C(C=C1)NC(=O)CC2=CC(=CC=C2)Cl)[N+](=O)[O-])N3C=CN=C3

InChI

InChI=1S/C21H21ClN4O3/c1-14(2)21(25-9-8-23-13-25)16-6-7-18(19(12-16)26(28)29)24-20(27)11-15-4-3-5-17(22)10-15/h3-10,12-14,21H,11H2,1-2H3,(H,24,27)