methyl-[(3S)-1-[3-(2-oxidanylidene-3H-benzimidazol-1-yl)propanoyl]piperidin-3-yl]-phenethyl-azanium

Systemtic Name: methyl-[(3S)-1-[3-(2-oxidanylidene-3H-benzimidazol-1-yl)propanoyl]piperidin-3-yl]-phenethyl-azanium Openeye Name: methyl-[(3S)-1-[3-(2-oxo-3H-benzimidazol-1-yl)propanoyl]-3-piperidyl]-phenethyl-ammonium CAS Name: methyl-[(3S)-1-[1-oxo-3-(2-oxo-3H-benzimidazol-1-yl)propyl]-3-piperidinyl]-phenethylammonium IUPAC Name: methyl-[(3S)-1-[3-(2-oxo-3H-benzimidazol-1-yl)propanoyl]piperidin-3-yl]-phenethylazanium Traditional Name: [(3S)-1-[3-(2-keto-3H-benzimidazol-1-yl)propanoyl]-3-piperidyl]-methyl-phenethyl-ammonium Formula: C24H31N4O2+ MolecularWeight: 407.52854

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)C2CCCN(C2)C(=O)CCN3C4=CC=CC=C4NC3=O

Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)[C@H]2CCCN(C2)C(=O)CCN3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C24H30N4O2/c1-26(16-13-19-8-3-2-4-9-19)20-10-7-15-27(18-20)23(29)14-17-28-22-12-6-5-11-21(22)25-24(28)30/h2-6,8-9,11-12,20H,7,10,13-18H2,1H3,(H,25,30)/p+1/t20-/m0/s1