[4-(cyclopropylamino)-3-nitro-phenyl]-(3,5-dimethylpiperidin-1-yl)methanone

Systemtic Name: [4-(cyclopropylamino)-3-nitro-phenyl]-(3,5-dimethylpiperidin-1-yl)methanone Openeye Name: [4-(cyclopropylamino)-3-nitro-phenyl]-(3,5-dimethyl-1-piperidyl)methanone CAS Name: [4-(cyclopropylamino)-3-nitrophenyl]-(3,5-dimethyl-1-piperidinyl)methanone IUPAC Name: [4-(cyclopropylamino)-3-nitrophenyl]-(3,5-dimethylpiperidin-1-yl)methanone Traditional Name: [4-(cyclopropylamino)-3-nitro-phenyl]-(3,5-dimethylpiperidino)methanone Formula: C17H23N3O3 MolecularWeight: 317.38282

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)C(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-])C

InChI

InChI=1S/C17H23N3O3/c1-11-7-12(2)10-19(9-11)17(21)13-3-6-15(18-14-4-5-14)16(8-13)20(22)23/h3,6,8,11-12,14,18H,4-5,7,9-10H2,1-2H3