(5S)-5-(4-ethanoyl-4-phenyl-piperidin-1-yl)carbonyl-1-(2-morpholin-4-ium-4-ylethyl)piperidin-2-one

Systemtic Name: (5S)-5-(4-ethanoyl-4-phenyl-piperidin-1-yl)carbonyl-1-(2-morpholin-4-ium-4-ylethyl)piperidin-2-one Openeye Name: (5S)-5-(4-acetyl-4-phenyl-piperidine-1-carbonyl)-1-(2-morpholin-4-ium-4-ylethyl)piperidin-2-one CAS Name: (5S)-5-[(4-acetyl-4-phenyl-1-piperidinyl)-oxomethyl]-1-[2-(4-morpholin-4-iumyl)ethyl]-2-piperidinone IUPAC Name: (5S)-5-(4-acetyl-4-phenylpiperidine-1-carbonyl)-1-(2-morpholin-4-ium-4-ylethyl)piperidin-2-one Traditional Name: (5S)-5-(4-acetyl-4-phenyl-piperidine-1-carbonyl)-1-(2-morpholin-4-ium-4-ylethyl)-2-piperidone Formula: C25H36N3O4+ MolecularWeight: 442.57104

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CCN(CC1)C(=O)C2CCC(=O)N(C2)CC[NH+]3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1(CCN(CC1)C(=O)[C@H]2CCC(=O)N(C2)CC[NH+]3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H35N3O4/c1-20(29)25(22-5-3-2-4-6-22)9-11-27(12-10-25)24(31)21-7-8-23(30)28(19-21)14-13-26-15-17-32-18-16-26/h2-6,21H,7-19H2,1H3/p+1/t21-/m0/s1