2-[1-[4-(3-ethoxyphenyl)piperazin-1-yl]butylamino]-5,5-dimethyl-cyclohex-2-en-1-one

Systemtic Name: 2-[1-[4-(3-ethoxyphenyl)piperazin-1-yl]butylamino]-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 2-[1-[4-(3-ethoxyphenyl)piperazin-1-yl]butylamino]-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 2-[1-[4-(3-ethoxyphenyl)-1-piperazinyl]butylamino]-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 2-[1-[4-(3-ethoxyphenyl)piperazin-1-yl]butylamino]-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 5,5-dimethyl-2-[1-(4-m-phenetylpiperazino)butylamino]cyclohex-2-en-1-one Formula: C24H37N3O2 MolecularWeight: 399.56948

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(NC1=CCC(CC1=O)(C)C)N2CCN(CC2)C3=CC(=CC=C3)OCC

Isomeric SMILES

CCCC(NC1=CCC(CC1=O)(C)C)N2CCN(CC2)C3=CC(=CC=C3)OCC

InChI

InChI=1S/C24H37N3O2/c1-5-8-23(25-21-11-12-24(3,4)18-22(21)28)27-15-13-26(14-16-27)19-9-7-10-20(17-19)29-6-2/h7,9-11,17,23,25H,5-6,8,12-16,18H2,1-4H3