1-cyclohexyl-1-oxidanyl-1-phenyl-7-[(phenylmethyl)amino]hept-5-yn-2-one

Systemtic Name: 1-cyclohexyl-1-oxidanyl-1-phenyl-7-[(phenylmethyl)amino]hept-5-yn-2-one Openeye Name: 7-(benzylamino)-1-cyclohexyl-1-hydroxy-1-phenyl-hept-5-yn-2-one CAS Name: 1-cyclohexyl-1-hydroxy-1-phenyl-7-[(phenylmethyl)amino]-5-heptyn-2-one IUPAC Name: 7-(benzylamino)-1-cyclohexyl-1-hydroxy-1-phenylhept-5-yn-2-one Traditional Name: 7-(benzylamino)-1-cyclohexyl-1-hydroxy-1-phenyl-hept-5-yn-2-one Formula: C26H31NO2 MolecularWeight: 389.52984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2=CC=CC=C2)(C(=O)CCC#CCNCC3=CC=CC=C3)O

Isomeric SMILES

C1CCC(CC1)C(C2=CC=CC=C2)(C(=O)CCC#CCNCC3=CC=CC=C3)O

InChI

InChI=1S/C26H31NO2/c28-25(19-11-4-12-20-27-21-22-13-5-1-6-14-22)26(29,23-15-7-2-8-16-23)24-17-9-3-10-18-24/h1-2,5-8,13-16,24,27,29H,3,9-11,17-21H2