(2S)-2-(2-methylphenoxy)-1-(4-propylpiperazin-1-yl)butan-1-one

Systemtic Name: (2S)-2-(2-methylphenoxy)-1-(4-propylpiperazin-1-yl)butan-1-one Openeye Name: (2S)-2-(2-methylphenoxy)-1-(4-propylpiperazin-1-yl)butan-1-one CAS Name: (2S)-2-(2-methylphenoxy)-1-(4-propyl-1-piperazinyl)-1-butanone IUPAC Name: (2S)-2-(2-methylphenoxy)-1-(4-propylpiperazin-1-yl)butan-1-one Traditional Name: (2S)-2-(2-methylphenoxy)-1-(4-propylpiperazino)butan-1-one Formula: C18H28N2O2 MolecularWeight: 304.42712

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=O)C(CC)OC2=CC=CC=C2C

Isomeric SMILES

CCCN1CCN(CC1)C(=O)[C@H](CC)OC2=CC=CC=C2C

InChI

InChI=1S/C18H28N2O2/c1-4-10-19-11-13-20(14-12-19)18(21)16(5-2)22-17-9-7-6-8-15(17)3/h6-9,16H,4-5,10-14H2,1-3H3/t16-/m0/s1