2-[(2S)-1-cyclopentyl-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(1-phenylpiperidin-4-yl)ethanamide

Systemtic Name: 2-[(2S)-1-cyclopentyl-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(1-phenylpiperidin-4-yl)ethanamide Openeye Name: 2-[(2S)-1-cyclopentyl-3-oxo-piperazin-1-ium-2-yl]-N-(1-phenyl-4-piperidyl)acetamide CAS Name: 2-[(2S)-1-cyclopentyl-3-oxo-2-piperazin-1-iumyl]-N-(1-phenyl-4-piperidinyl)acetamide IUPAC Name: 2-[(2S)-1-cyclopentyl-3-oxopiperazin-1-ium-2-yl]-N-(1-phenylpiperidin-4-yl)acetamide Traditional Name: 2-[(2S)-1-cyclopentyl-3-keto-piperazin-1-ium-2-yl]-N-(1-phenyl-4-piperidyl)acetamide Formula: C22H33N4O2+ MolecularWeight: 385.52302

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCNC(=O)C2CC(=O)NC3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)[NH+]2CCNC(=O)[C@@H]2CC(=O)NC3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H32N4O2/c27-21(16-20-22(28)23-12-15-26(20)19-8-4-5-9-19)24-17-10-13-25(14-11-17)18-6-2-1-3-7-18/h1-3,6-7,17,19-20H,4-5,8-16H2,(H,23,28)(H,24,27)/p+1/t20-/m0/s1