(5S)-5-[4-(4-ethanoylphenyl)piperazin-1-yl]carbonyl-1-(2-morpholin-4-ium-4-ylethyl)piperidin-2-one

Systemtic Name: (5S)-5-[4-(4-ethanoylphenyl)piperazin-1-yl]carbonyl-1-(2-morpholin-4-ium-4-ylethyl)piperidin-2-one Openeye Name: (5S)-5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ium-4-ylethyl)piperidin-2-one CAS Name: (5S)-5-[[4-(4-acetylphenyl)-1-piperazinyl]-oxomethyl]-1-[2-(4-morpholin-4-iumyl)ethyl]-2-piperidinone IUPAC Name: (5S)-5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ium-4-ylethyl)piperidin-2-one Traditional Name: (5S)-5-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-(2-morpholin-4-ium-4-ylethyl)-2-piperidone Formula: C24H35N4O4+ MolecularWeight: 443.5591

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3CCC(=O)N(C3)CC[NH+]4CCOCC4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)[C@H]3CCC(=O)N(C3)CC[NH+]4CCOCC4

InChI

InChI=1S/C24H34N4O4/c1-19(29)20-2-5-22(6-3-20)26-10-12-27(13-11-26)24(31)21-4-7-23(30)28(18-21)9-8-25-14-16-32-17-15-25/h2-3,5-6,21H,4,7-18H2,1H3/p+1/t21-/m0/s1