(E)-1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-3-(5-nitrothiophen-2-yl)prop-2-en-1-one

Systemtic Name: (E)-1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-3-(5-nitrothiophen-2-yl)prop-2-en-1-one Openeye Name: (E)-1-[(3R,5R)-3,5-dimethyl-1-piperidyl]-3-(5-nitro-2-thienyl)prop-2-en-1-one CAS Name: (E)-1-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-3-(5-nitro-2-thiophenyl)-2-propen-1-one IUPAC Name: (E)-1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-3-(5-nitrothiophen-2-yl)prop-2-en-1-one Traditional Name: (E)-1-[(3R,5R)-3,5-dimethylpiperidino]-3-(5-nitro-2-thienyl)prop-2-en-1-one Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C=CC2=CC=C(S2)[N+](=O)[O-])C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)C(=O)/C=C/C2=CC=C(S2)[N+](=O)[O-])C

InChI

InChI=1S/C14H18N2O3S/c1-10-7-11(2)9-15(8-10)13(17)5-3-12-4-6-14(20-12)16(18)19/h3-6,10-11H,7-9H2,1-2H3/b5-3+/t10-,11-/m1/s1