1-(4-fluorophenyl)-4-piperazin-1-yl-butan-1-one; methoxybenzene

Systemtic Name: 1-(4-fluorophenyl)-4-piperazin-1-yl-butan-1-one; methoxybenzene Openeye Name: anisole; 1-(4-fluorophenyl)-4-piperazin-1-yl-butan-1-one CAS Name: 1-(4-fluorophenyl)-4-(1-piperazinyl)-1-butanone; methoxybenzene IUPAC Name: anisole; 1-(4-fluorophenyl)-4-piperazin-1-ylbutan-1-one Traditional Name: anisole; 1-(4-fluorophenyl)-4-piperazino-butan-1-one Formula: C21H27FN2O2 MolecularWeight: 358.449683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1.C1CN(CCN1)CCCC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

COC1=CC=CC=C1.C1CN(CCN1)CCCC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C14H19FN2O.C7H8O/c15-13-5-3-12(4-6-13)14(18)2-1-9-17-10-7-16-8-11-17;1-8-7-5-3-2-4-6-7/h3-6,16H,1-2,7-11H2;2-6H,1H3