(5S)-5-[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-1-yl]carbonyl-1-(3-phenylpropyl)piperidin-2-one

Systemtic Name: (5S)-5-[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazin-1-yl]carbonyl-1-(3-phenylpropyl)piperidin-2-one Openeye Name: (5S)-5-[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazine-1-carbonyl]-1-(3-phenylpropyl)piperidin-2-one CAS Name: (5S)-5-[[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]-1-piperazinyl]-oxomethyl]-1-(3-phenylpropyl)-2-piperidinone IUPAC Name: (5S)-5-[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazine-1-carbonyl]-1-(3-phenylpropyl)piperidin-2-one Traditional Name: (5S)-5-[4-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]piperazine-1-carbonyl]-1-(3-phenylpropyl)-2-piperidone Formula: C24H34N5O2+ MolecularWeight: 424.55906

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC=C1)CN2CCN(CC2)C(=O)C3CCC(=O)N(C3)CCCC4=CC=CC=C4

Isomeric SMILES

C[N+]1=C(NC=C1)CN2CCN(CC2)C(=O)[C@H]3CCC(=O)N(C3)CCCC4=CC=CC=C4

InChI

InChI=1S/C24H33N5O2/c1-26-13-11-25-22(26)19-27-14-16-28(17-15-27)24(31)21-9-10-23(30)29(18-21)12-5-8-20-6-3-2-4-7-20/h2-4,6-7,11,13,21H,5,8-10,12,14-19H2,1H3/p+1/t21-/m0/s1