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

Systemtic Name: (3,5-dimethylpiperidin-1-yl)-(3-nitro-4-piperidin-1-yl-phenyl)methanone Openeye Name: (3,5-dimethyl-1-piperidyl)-[3-nitro-4-(1-piperidyl)phenyl]methanone CAS Name: (3,5-dimethyl-1-piperidinyl)-[3-nitro-4-(1-piperidinyl)phenyl]methanone IUPAC Name: (3,5-dimethylpiperidin-1-yl)-(3-nitro-4-piperidin-1-ylphenyl)methanone Traditional Name: (3,5-dimethylpiperidino)-(3-nitro-4-piperidino-phenyl)methanone Formula: C19H27N3O3 MolecularWeight: 345.43598

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)C(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-])C

InChI

InChI=1S/C19H27N3O3/c1-14-10-15(2)13-21(12-14)19(23)16-6-7-17(18(11-16)22(24)25)20-8-4-3-5-9-20/h6-7,11,14-15H,3-5,8-10,12-13H2,1-2H3