4-[(2-azanylcyclohexyl)methyl]-6-[(4-fluorophenyl)methyl]-3-(hydroxymethyl)piperazin-2-one

Systemtic Name: 4-[(2-azanylcyclohexyl)methyl]-6-[(4-fluorophenyl)methyl]-3-(hydroxymethyl)piperazin-2-one Openeye Name: 4-[(2-aminocyclohexyl)methyl]-6-[(4-fluorophenyl)methyl]-3-(hydroxymethyl)piperazin-2-one CAS Name: 4-[(2-aminocyclohexyl)methyl]-6-[(4-fluorophenyl)methyl]-3-(hydroxymethyl)-2-piperazinone IUPAC Name: 4-[(2-aminocyclohexyl)methyl]-6-[(4-fluorophenyl)methyl]-3-(hydroxymethyl)piperazin-2-one Traditional Name: 4-[(2-aminocyclohexyl)methyl]-6-(4-fluorobenzyl)-3-methylol-piperazin-2-one Formula: C19H28FN3O2 MolecularWeight: 349.442923

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)CN2CC(NC(=O)C2CO)CC3=CC=C(C=C3)F)N

Isomeric SMILES

C1CCC(C(C1)CN2CC(NC(=O)C2CO)CC3=CC=C(C=C3)F)N

InChI

InChI=1S/C19H28FN3O2/c20-15-7-5-13(6-8-15)9-16-11-23(18(12-24)19(25)22-16)10-14-3-1-2-4-17(14)21/h5-8,14,16-18,24H,1-4,9-12,21H2,(H,22,25)