1-[(2-oxidanylidene-3-propyl-benzimidazol-1-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2-oxidanylidene-3-propyl-benzimidazol-1-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2-oxo-3-propyl-benzimidazol-1-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(2-oxo-3-propyl-1-benzimidazolyl)methyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2-oxo-3-propylbenzimidazol-1-yl)methyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[(2-keto-3-propyl-benzimidazol-1-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N(C1=O)C[NH+]3CCC(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CCCN1C2=CC=CC=C2N(C1=O)C[NH+]3CCC(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O2/c1-2-14-26-20-10-6-7-11-21(20)27(23(26)29)17-25-15-12-18(13-16-25)22(28)24-19-8-4-3-5-9-19/h3-11,18H,2,12-17H2,1H3,(H,24,28)/p+1