1-(4-fluorophenyl)-4-[[4-(hydroxymethyl)-4-naphthalen-1-yl-cyclohexyl]amino]butan-1-one

Systemtic Name: 1-(4-fluorophenyl)-4-[[4-(hydroxymethyl)-4-naphthalen-1-yl-cyclohexyl]amino]butan-1-one Openeye Name: 1-(4-fluorophenyl)-4-[[4-(hydroxymethyl)-4-(1-naphthyl)cyclohexyl]amino]butan-1-one CAS Name: 1-(4-fluorophenyl)-4-[[4-(hydroxymethyl)-4-(1-naphthalenyl)cyclohexyl]amino]-1-butanone IUPAC Name: 1-(4-fluorophenyl)-4-[[4-(hydroxymethyl)-4-naphthalen-1-ylcyclohexyl]amino]butan-1-one Traditional Name: 1-(4-fluorophenyl)-4-[[4-methylol-4-(1-naphthyl)cyclohexyl]amino]butan-1-one Formula: C27H30FNO2 MolecularWeight: 419.531003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NCCCC(=O)C2=CC=C(C=C2)F)(CO)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CC(CCC1NCCCC(=O)C2=CC=C(C=C2)F)(CO)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H30FNO2/c28-22-12-10-21(11-13-22)26(31)9-4-18-29-23-14-16-27(19-30,17-15-23)25-8-3-6-20-5-1-2-7-24(20)25/h1-3,5-8,10-13,23,29-30H,4,9,14-19H2