1-[4-[(2S)-3-[2-(cyclohexen-1-yl)ethylamino]-2-oxidanyl-propoxy]phenyl]ethanone

Systemtic Name: 1-[4-[(2S)-3-[2-(cyclohexen-1-yl)ethylamino]-2-oxidanyl-propoxy]phenyl]ethanone Openeye Name: 1-[4-[(2S)-3-[2-(cyclohexen-1-yl)ethylamino]-2-hydroxy-propoxy]phenyl]ethanone CAS Name: 1-[4-[(2S)-3-[2-(1-cyclohexenyl)ethylamino]-2-hydroxypropoxy]phenyl]ethanone IUPAC Name: 1-[4-[(2S)-3-[2-(cyclohexen-1-yl)ethylamino]-2-hydroxypropoxy]phenyl]ethanone Traditional Name: 1-[4-[(2S)-3-[2-(cyclohexen-1-yl)ethylamino]-2-hydroxy-propoxy]phenyl]ethanone Formula: C19H27NO3 MolecularWeight: 317.42258

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC(CNCCC2=CCCCC2)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC[C@H](CNCCC2=CCCCC2)O

InChI

InChI=1S/C19H27NO3/c1-15(21)17-7-9-19(10-8-17)23-14-18(22)13-20-12-11-16-5-3-2-4-6-16/h5,7-10,18,20,22H,2-4,6,11-14H2,1H3/t18-/m0/s1