ethyl-[(3S)-1-[3-(2-oxidanylidene-3H-benzimidazol-1-yl)propanoyl]piperidin-3-yl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: ethyl-[(3S)-1-[3-(2-oxidanylidene-3H-benzimidazol-1-yl)propanoyl]piperidin-3-yl]-(pyridin-4-ylmethyl)azanium Openeye Name: ethyl-[(3S)-1-[3-(2-oxo-3H-benzimidazol-1-yl)propanoyl]-3-piperidyl]-(4-pyridylmethyl)ammonium CAS Name: ethyl-[(3S)-1-[1-oxo-3-(2-oxo-3H-benzimidazol-1-yl)propyl]-3-piperidinyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: ethyl-[(3S)-1-[3-(2-oxo-3H-benzimidazol-1-yl)propanoyl]piperidin-3-yl]-(pyridin-4-ylmethyl)azanium Traditional Name: ethyl-[(3S)-1-[3-(2-keto-3H-benzimidazol-1-yl)propanoyl]-3-piperidyl]-(4-pyridylmethyl)ammonium Formula: C23H30N5O2+ MolecularWeight: 408.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=NC=C1)C2CCCN(C2)C(=O)CCN3C4=CC=CC=C4NC3=O

Isomeric SMILES

CC[NH+](CC1=CC=NC=C1)[C@H]2CCCN(C2)C(=O)CCN3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C23H29N5O2/c1-2-26(16-18-9-12-24-13-10-18)19-6-5-14-27(17-19)22(29)11-15-28-21-8-4-3-7-20(21)25-23(28)30/h3-4,7-10,12-13,19H,2,5-6,11,14-17H2,1H3,(H,25,30)/p+1/t19-/m0/s1