1-[4-(1-oxidanylcyclohexyl)phenyl]-3-[(2-piperazin-1-ylphenyl)methyl]pyrrolidin-2-one

Systemtic Name: 1-[4-(1-oxidanylcyclohexyl)phenyl]-3-[(2-piperazin-1-ylphenyl)methyl]pyrrolidin-2-one Openeye Name: 1-[4-(1-hydroxycyclohexyl)phenyl]-3-[(2-piperazin-1-ylphenyl)methyl]pyrrolidin-2-one CAS Name: 1-[4-(1-hydroxycyclohexyl)phenyl]-3-[[2-(1-piperazinyl)phenyl]methyl]-2-pyrrolidinone IUPAC Name: 1-[4-(1-hydroxycyclohexyl)phenyl]-3-[(2-piperazin-1-ylphenyl)methyl]pyrrolidin-2-one Traditional Name: 1-[4-(1-hydroxycyclohexyl)phenyl]-3-(2-piperazinobenzyl)-2-pyrrolidone Formula: C27H35N3O2 MolecularWeight: 433.5857

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C2=CC=C(C=C2)N3CCC(C3=O)CC4=CC=CC=C4N5CCNCC5)O

Isomeric SMILES

C1CCC(CC1)(C2=CC=C(C=C2)N3CCC(C3=O)CC4=CC=CC=C4N5CCNCC5)O

InChI

InChI=1S/C27H35N3O2/c31-26-22(20-21-6-2-3-7-25(21)29-18-15-28-16-19-29)12-17-30(26)24-10-8-23(9-11-24)27(32)13-4-1-5-14-27/h2-3,6-11,22,28,32H,1,4-5,12-20H2