(3R)-4-(2,2-diphenylethyl)-3-[2-oxidanylidene-2-(4-oxidanylpiperidin-1-yl)ethyl]piperazin-4-ium-2-one

Systemtic Name: (3R)-4-(2,2-diphenylethyl)-3-[2-oxidanylidene-2-(4-oxidanylpiperidin-1-yl)ethyl]piperazin-4-ium-2-one Openeye Name: (3R)-4-(2,2-diphenylethyl)-3-[2-(4-hydroxy-1-piperidyl)-2-oxo-ethyl]piperazin-4-ium-2-one CAS Name: (3R)-4-(2,2-diphenylethyl)-3-[2-(4-hydroxy-1-piperidinyl)-2-oxoethyl]-2-piperazin-4-iumone IUPAC Name: (3R)-4-(2,2-diphenylethyl)-3-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]piperazin-4-ium-2-one Traditional Name: (3R)-4-(2,2-diphenylethyl)-3-[2-(4-hydroxypiperidino)-2-keto-ethyl]piperazin-4-ium-2-one Formula: C25H32N3O3+ MolecularWeight: 422.53988

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C(=O)CC2C(=O)NCC[NH+]2CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1O)C(=O)C[C@@H]2C(=O)NCC[NH+]2CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H31N3O3/c29-21-11-14-27(15-12-21)24(30)17-23-25(31)26-13-16-28(23)18-22(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-10,21-23,29H,11-18H2,(H,26,31)/p+1/t23-/m1/s1