ethyl 1-(1H-benzimidazol-2-ylamino)-4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)piperidin-1-ium-1-carboxylate

Systemtic Name: ethyl 1-(1H-benzimidazol-2-ylamino)-4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)piperidin-1-ium-1-carboxylate Openeye Name: ethyl 1-(1H-benzimidazol-2-ylamino)-4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)piperidin-1-ium-1-carboxylate CAS Name: 1-(1H-benzimidazol-2-ylamino)-4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1H-benzimidazol-2-ylamino)-4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)piperidin-1-ium-1-carboxylate Traditional Name: 1-(1H-benzimidazol-2-ylamino)-4-(1-pyrindan-7-yl)piperidin-1-ium-1-carboxylic acid ethyl ester Formula: C23H28N5O2+ MolecularWeight: 406.50072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)[N+]1(CCC(CC1)C2CCC3=C2N=CC=C3)NC4=NC5=CC=CC=C5N4

Isomeric SMILES

CCOC(=O)[N+]1(CCC(CC1)C2CCC3=C2N=CC=C3)NC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C23H28N5O2/c1-2-30-23(29)28(27-22-25-19-7-3-4-8-20(19)26-22)14-11-16(12-15-28)18-10-9-17-6-5-13-24-21(17)18/h3-8,13,16,18H,2,9-12,14-15H2,1H3,(H2,25,26,27)/q+1