1-[4-[3-(3,4-dimethylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-3-piperidin-1-yl-propan-1-one

Systemtic Name: 1-[4-[3-(3,4-dimethylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-3-piperidin-1-yl-propan-1-one Openeye Name: 1-[4-[3-(3,4-dimethylphenoxy)-2-hydroxy-propyl]piperazin-1-yl]-3-(1-piperidyl)propan-1-one CAS Name: 1-[4-[3-(3,4-dimethylphenoxy)-2-hydroxypropyl]-1-piperazinyl]-3-(1-piperidinyl)-1-propanone IUPAC Name: 1-[4-[3-(3,4-dimethylphenoxy)-2-hydroxypropyl]piperazin-1-yl]-3-piperidin-1-ylpropan-1-one Traditional Name: 1-[4-[3-(3,4-dimethylphenoxy)-2-hydroxy-propyl]piperazino]-3-piperidino-propan-1-one Formula: C23H37N3O3 MolecularWeight: 403.55818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(CN2CCN(CC2)C(=O)CCN3CCCCC3)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(CN2CCN(CC2)C(=O)CCN3CCCCC3)O)C

InChI

InChI=1S/C23H37N3O3/c1-19-6-7-22(16-20(19)2)29-18-21(27)17-25-12-14-26(15-13-25)23(28)8-11-24-9-4-3-5-10-24/h6-7,16,21,27H,3-5,8-15,17-18H2,1-2H3