2-(2,4-dipentylphenoxy)-1-(4-methylpiperazin-1-yl)butan-1-one

Systemtic Name: 2-(2,4-dipentylphenoxy)-1-(4-methylpiperazin-1-yl)butan-1-one Openeye Name: 2-(2,4-dipentylphenoxy)-1-(4-methylpiperazin-1-yl)butan-1-one CAS Name: 2-(2,4-dipentylphenoxy)-1-(4-methyl-1-piperazinyl)-1-butanone IUPAC Name: 2-(2,4-dipentylphenoxy)-1-(4-methylpiperazin-1-yl)butan-1-one Traditional Name: 2-(2,4-diamylphenoxy)-1-(4-methylpiperazino)butan-1-one Formula: C25H42N2O2 MolecularWeight: 402.61318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)OC(CC)C(=O)N2CCN(CC2)C)CCCCC

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)OC(CC)C(=O)N2CCN(CC2)C)CCCCC

InChI

InChI=1S/C25H42N2O2/c1-5-8-10-12-21-14-15-24(22(20-21)13-11-9-6-2)29-23(7-3)25(28)27-18-16-26(4)17-19-27/h14-15,20,23H,5-13,16-19H2,1-4H3