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

Systemtic Name: [4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-3-nitro-phenyl]-(4-nitrophenyl)methanone Openeye Name: [4-[(3R,5R)-3,5-dimethyl-1-piperidyl]-3-nitro-phenyl]-(4-nitrophenyl)methanone CAS Name: [4-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-3-nitrophenyl]-(4-nitrophenyl)methanone IUPAC Name: [4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-3-nitrophenyl]-(4-nitrophenyl)methanone Traditional Name: [4-[(3R,5R)-3,5-dimethylpiperidino]-3-nitro-phenyl]-(4-nitrophenyl)methanone Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)C2=C(C=C(C=C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C20H21N3O5/c1-13-9-14(2)12-21(11-13)18-8-5-16(10-19(18)23(27)28)20(24)15-3-6-17(7-4-15)22(25)26/h3-8,10,13-14H,9,11-12H2,1-2H3/t13-,14-/m1/s1