3-(4-ethylphenyl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-ethylphenyl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(4-ethylphenyl)-1-[4-(3-pyridylmethyl)piperazin-1-yl]propan-1-one CAS Name: 3-(4-ethylphenyl)-1-[4-(3-pyridinylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-ethylphenyl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(4-ethylphenyl)-1-[4-(3-pyridylmethyl)piperazino]propan-1-one Formula: C21H27N3O MolecularWeight: 337.45858

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CCC(=O)N2CCN(CC2)CC3=CN=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)CCC(=O)N2CCN(CC2)CC3=CN=CC=C3

InChI

InChI=1S/C21H27N3O/c1-2-18-5-7-19(8-6-18)9-10-21(25)24-14-12-23(13-15-24)17-20-4-3-11-22-16-20/h3-8,11,16H,2,9-10,12-15,17H2,1H3