1-[1-[3-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]naphthalen-2-yl]propan-1-one

Systemtic Name: 1-[1-[3-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]naphthalen-2-yl]propan-1-one Openeye Name: 1-[1-[3-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-hydroxy-propoxy]-2-naphthyl]propan-1-one CAS Name: 1-[1-[3-[4-(3,4-dimethylphenyl)-1-piperazinyl]-2-hydroxypropoxy]-2-naphthalenyl]-1-propanone IUPAC Name: 1-[1-[3-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-hydroxypropoxy]naphthalen-2-yl]propan-1-one Traditional Name: 1-[1-[3-[4-(3,4-dimethylphenyl)piperazino]-2-hydroxy-propoxy]-2-naphthyl]propan-1-one Formula: C28H34N2O3 MolecularWeight: 446.58116

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C2=CC=CC=C2C=C1)OCC(CN3CCN(CC3)C4=CC(=C(C=C4)C)C)O

Isomeric SMILES

CCC(=O)C1=C(C2=CC=CC=C2C=C1)OCC(CN3CCN(CC3)C4=CC(=C(C=C4)C)C)O

InChI

InChI=1S/C28H34N2O3/c1-4-27(32)26-12-10-22-7-5-6-8-25(22)28(26)33-19-24(31)18-29-13-15-30(16-14-29)23-11-9-20(2)21(3)17-23/h5-12,17,24,31H,4,13-16,18-19H2,1-3H3