1-[3-[3-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]ethanone

Systemtic Name: 1-[3-[3-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]ethanone Openeye Name: 1-[3-[3-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-hydroxy-propoxy]phenyl]ethanone CAS Name: 1-[3-[3-[4-(3,4-dimethylphenyl)-1-piperazinyl]-2-hydroxypropoxy]phenyl]ethanone IUPAC Name: 1-[3-[3-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-hydroxypropoxy]phenyl]ethanone Traditional Name: 1-[3-[3-[4-(3,4-dimethylphenyl)piperazino]-2-hydroxy-propoxy]phenyl]ethanone Formula: C23H30N2O3 MolecularWeight: 382.4959

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CCN(CC2)CC(COC3=CC=CC(=C3)C(=O)C)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CCN(CC2)CC(COC3=CC=CC(=C3)C(=O)C)O)C

InChI

InChI=1S/C23H30N2O3/c1-17-7-8-21(13-18(17)2)25-11-9-24(10-12-25)15-22(27)16-28-23-6-4-5-20(14-23)19(3)26/h4-8,13-14,22,27H,9-12,15-16H2,1-3H3