1-[3-[[(2S,6S)-6-butyl-2-prop-2-enyl-3,6-dihydro-2H-pyridin-1-yl]carbonyl]phenyl]ethanone

Systemtic Name: 1-[3-[[(2S,6S)-6-butyl-2-prop-2-enyl-3,6-dihydro-2H-pyridin-1-yl]carbonyl]phenyl]ethanone Openeye Name: 1-[3-[(2S,6S)-2-allyl-6-butyl-3,6-dihydro-2H-pyridine-1-carbonyl]phenyl]ethanone CAS Name: 1-[3-[[(2S,6S)-6-butyl-2-prop-2-enyl-3,6-dihydro-2H-pyridin-1-yl]-oxomethyl]phenyl]ethanone IUPAC Name: 1-[3-[(2S,6S)-6-butyl-2-prop-2-enyl-3,6-dihydro-2H-pyridine-1-carbonyl]phenyl]ethanone Traditional Name: 1-[3-[(2S,6S)-2-allyl-6-butyl-3,6-dihydro-2H-pyridine-1-carbonyl]phenyl]ethanone Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C=CCC(N1C(=O)C2=CC=CC(=C2)C(=O)C)CC=C

Isomeric SMILES

CCCC[C@H]1C=CC[C@@H](N1C(=O)C2=CC=CC(=C2)C(=O)C)CC=C

InChI

InChI=1S/C21H27NO2/c1-4-6-12-20-14-8-13-19(9-5-2)22(20)21(24)18-11-7-10-17(15-18)16(3)23/h5,7-8,10-11,14-15,19-20H,2,4,6,9,12-13H2,1,3H3/t19-,20-/m0/s1