3-methyl-1-[4-[(3-phenoxyphenyl)methyl]piperazin-1-yl]butan-1-one

Systemtic Name: 3-methyl-1-[4-[(3-phenoxyphenyl)methyl]piperazin-1-yl]butan-1-one Openeye Name: 3-methyl-1-[4-[(3-phenoxyphenyl)methyl]piperazin-1-yl]butan-1-one CAS Name: 3-methyl-1-[4-[(3-phenoxyphenyl)methyl]-1-piperazinyl]-1-butanone IUPAC Name: 3-methyl-1-[4-[(3-phenoxyphenyl)methyl]piperazin-1-yl]butan-1-one Traditional Name: 3-methyl-1-[4-(3-phenoxybenzyl)piperazino]butan-1-one Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)CC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)CC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O2/c1-18(2)15-22(25)24-13-11-23(12-14-24)17-19-7-6-10-21(16-19)26-20-8-4-3-5-9-20/h3-10,16,18H,11-15,17H2,1-2H3