(5S)-3-[(4-methylpiperazin-4-ium-1-yl)amino]-5-phenyl-cyclohex-2-en-1-one

Systemtic Name: (5S)-3-[(4-methylpiperazin-4-ium-1-yl)amino]-5-phenyl-cyclohex-2-en-1-one Openeye Name: (5S)-3-[(4-methylpiperazin-4-ium-1-yl)amino]-5-phenyl-cyclohex-2-en-1-one CAS Name: (5S)-3-[(4-methyl-1-piperazin-4-iumyl)amino]-5-phenyl-1-cyclohex-2-enone IUPAC Name: (5S)-3-[(4-methylpiperazin-4-ium-1-yl)amino]-5-phenylcyclohex-2-en-1-one Traditional Name: (5S)-3-[(4-methylpiperazin-4-ium-1-yl)amino]-5-phenyl-cyclohex-2-en-1-one Formula: C17H24N3O+ MolecularWeight: 286.39196

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC2=CC(=O)CC(C2)C3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)NC2=CC(=O)C[C@H](C2)C3=CC=CC=C3

InChI

InChI=1S/C17H23N3O/c1-19-7-9-20(10-8-19)18-16-11-15(12-17(21)13-16)14-5-3-2-4-6-14/h2-6,13,15,18H,7-12H2,1H3/p+1/t15-/m0/s1