(2R)-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2R)-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2R)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide CAS Name: (2R)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-(4-phenyl-1-piperazin-1-iumyl)propanamide IUPAC Name: (2R)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-(4-phenylpiperazin-1-ium-1-yl)propanamide Traditional Name: (2R)-N-(2-keto-1,3-dihydrobenzimidazol-5-yl)-2-(4-phenylpiperazin-1-ium-1-yl)propionamide Formula: C20H24N5O2+ MolecularWeight: 366.43686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=C(C=C1)NC(=O)N2)[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C20H23N5O2/c1-14(24-9-11-25(12-10-24)16-5-3-2-4-6-16)19(26)21-15-7-8-17-18(13-15)23-20(27)22-17/h2-8,13-14H,9-12H2,1H3,(H,21,26)(H2,22,23,27)/p+1/t14-/m1/s1