(3,5-dimethylpiperidin-1-yl)-(4-imidazol-1-yl-3-nitro-phenyl)methanone

Systemtic Name: (3,5-dimethylpiperidin-1-yl)-(4-imidazol-1-yl-3-nitro-phenyl)methanone Openeye Name: (3,5-dimethyl-1-piperidyl)-(4-imidazol-1-yl-3-nitro-phenyl)methanone CAS Name: (3,5-dimethyl-1-piperidinyl)-[4-(1-imidazolyl)-3-nitrophenyl]methanone IUPAC Name: (3,5-dimethylpiperidin-1-yl)-(4-imidazol-1-yl-3-nitrophenyl)methanone Traditional Name: (3,5-dimethylpiperidino)-(4-imidazol-1-yl-3-nitro-phenyl)methanone Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)C(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])C

InChI

InChI=1S/C17H20N4O3/c1-12-7-13(2)10-20(9-12)17(22)14-3-4-15(16(8-14)21(23)24)19-6-5-18-11-19/h3-6,8,11-13H,7,9-10H2,1-2H3