N-[(2R)-1-oxidanylidene-3-phenyl-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)propan-2-yl]benzamide

Systemtic Name: N-[(2R)-1-oxidanylidene-3-phenyl-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)propan-2-yl]benzamide Openeye Name: N-[(1R)-1-benzyl-2-oxo-2-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethyl]benzamide CAS Name: N-[(2R)-1-oxo-3-phenyl-1-[4-(4-pyridin-1-iumyl)-1-piperazinyl]propan-2-yl]benzamide IUPAC Name: N-[(2R)-1-oxo-3-phenyl-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)propan-2-yl]benzamide Traditional Name: N-[(1R)-1-benzyl-2-keto-2-(4-pyridin-1-ium-4-ylpiperazino)ethyl]benzamide Formula: C25H27N4O2+ MolecularWeight: 415.50748

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=[NH+]C=C2)C(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=[NH+]C=C2)C(=O)[C@@H](CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H26N4O2/c30-24(21-9-5-2-6-10-21)27-23(19-20-7-3-1-4-8-20)25(31)29-17-15-28(16-18-29)22-11-13-26-14-12-22/h1-14,23H,15-19H2,(H,27,30)/p+1/t23-/m1/s1