cyclohexen-1-yl-[(3R,4R)-3-oxidanyl-4-(4-phenethylpiperazin-1-yl)piperidin-1-yl]methanone

Systemtic Name: cyclohexen-1-yl-[(3R,4R)-3-oxidanyl-4-(4-phenethylpiperazin-1-yl)piperidin-1-yl]methanone Openeye Name: cyclohexen-1-yl-[(3R,4R)-3-hydroxy-4-(4-phenethylpiperazin-1-yl)-1-piperidyl]methanone CAS Name: 1-cyclohexenyl-[(3R,4R)-3-hydroxy-4-(4-phenethyl-1-piperazinyl)-1-piperidinyl]methanone IUPAC Name: cyclohexen-1-yl-[(3R,4R)-3-hydroxy-4-(4-phenethylpiperazin-1-yl)piperidin-1-yl]methanone Traditional Name: cyclohexen-1-yl-[(3R,4R)-3-hydroxy-4-(4-phenethylpiperazino)piperidino]methanone Formula: C24H35N3O2 MolecularWeight: 397.5536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)C(=O)N2CCC(C(C2)O)N3CCN(CC3)CCC4=CC=CC=C4

Isomeric SMILES

C1CCC(=CC1)C(=O)N2CC[C@H]([C@@H](C2)O)N3CCN(CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C24H35N3O2/c28-23-19-27(24(29)21-9-5-2-6-10-21)14-12-22(23)26-17-15-25(16-18-26)13-11-20-7-3-1-4-8-20/h1,3-4,7-9,22-23,28H,2,5-6,10-19H2/t22-,23-/m1/s1