2-[(2R)-1-[(4-ethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(1-phenylpiperidin-4-yl)ethanamide

Systemtic Name: 2-[(2R)-1-[(4-ethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(1-phenylpiperidin-4-yl)ethanamide Openeye Name: 2-[(2R)-1-[(4-ethoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-(1-phenyl-4-piperidyl)acetamide CAS Name: 2-[(2R)-1-[(4-ethoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-(1-phenyl-4-piperidinyl)acetamide IUPAC Name: 2-[(2R)-1-[(4-ethoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-(1-phenylpiperidin-4-yl)acetamide Traditional Name: 2-[(2R)-1-(4-ethoxybenzyl)-3-keto-piperazin-1-ium-2-yl]-N-(1-phenyl-4-piperidyl)acetamide Formula: C26H35N4O3+ MolecularWeight: 451.5811

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+]2CCNC(=O)C2CC(=O)NC3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+]2CCNC(=O)[C@H]2CC(=O)NC3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H34N4O3/c1-2-33-23-10-8-20(9-11-23)19-30-17-14-27-26(32)24(30)18-25(31)28-21-12-15-29(16-13-21)22-6-4-3-5-7-22/h3-11,21,24H,2,12-19H2,1H3,(H,27,32)(H,28,31)/p+1/t24-/m1/s1