3-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: 3-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: 3-[(3S)-3-methyl-1-piperidin-1-iumyl]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 3-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: 3-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-(4-phenylpiperazino)propan-1-one Formula: C19H30N3O+ MolecularWeight: 316.461

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCC(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CCC(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H29N3O/c1-17-6-5-10-20(16-17)11-9-19(23)22-14-12-21(13-15-22)18-7-3-2-4-8-18/h2-4,7-8,17H,5-6,9-16H2,1H3/p+1/t17-/m0/s1