[(3S,5S)-3,5-dimethylpiperidin-1-yl]-[5-(4-nitrophenyl)furan-2-yl]methanone

Systemtic Name: [(3S,5S)-3,5-dimethylpiperidin-1-yl]-[5-(4-nitrophenyl)furan-2-yl]methanone Openeye Name: [(3S,5S)-3,5-dimethyl-1-piperidyl]-[5-(4-nitrophenyl)-2-furyl]methanone CAS Name: [(3S,5S)-3,5-dimethyl-1-piperidinyl]-[5-(4-nitrophenyl)-2-furanyl]methanone IUPAC Name: [(3S,5S)-3,5-dimethylpiperidin-1-yl]-[5-(4-nitrophenyl)furan-2-yl]methanone Traditional Name: [(3S,5S)-3,5-dimethylpiperidino]-[5-(4-nitrophenyl)-2-furyl]methanone Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C(=O)C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H20N2O4/c1-12-9-13(2)11-19(10-12)18(21)17-8-7-16(24-17)14-3-5-15(6-4-14)20(22)23/h3-8,12-13H,9-11H2,1-2H3/t12-,13-/m0/s1