(3S)-N-[4-(1H-benzimidazol-2-yl)phenyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-[4-(1H-benzimidazol-2-yl)phenyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-[4-(1H-benzimidazol-2-yl)phenyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-[4-(1H-benzimidazol-2-yl)phenyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-[4-(1H-benzimidazol-2-yl)phenyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-[4-(1H-benzimidazol-2-yl)phenyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-3-carboxamide Formula: C24H27N6O+ MolecularWeight: 415.51078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1)C[NH+]2CCCC(C2)C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=NC=C(N1)C[NH+]2CCC[C@@H](C2)C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C24H26N6O/c1-16-25-13-20(26-16)15-30-12-4-5-18(14-30)24(31)27-19-10-8-17(9-11-19)23-28-21-6-2-3-7-22(21)29-23/h2-3,6-11,13,18H,4-5,12,14-15H2,1H3,(H,25,26)(H,27,31)(H,28,29)/p+1/t18-/m0/s1