N-cyclopentyl-1-methyl-5-[(3-phenylmethoxyphenyl)methyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxamide

Systemtic Name: N-cyclopentyl-1-methyl-5-[(3-phenylmethoxyphenyl)methyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxamide Openeye Name: 5-[(3-benzyloxyphenyl)methyl]-N-cyclopentyl-1-methyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxamide CAS Name: N-cyclopentyl-1-methyl-5-[(3-phenylmethoxyphenyl)methyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxamide IUPAC Name: N-cyclopentyl-1-methyl-5-[(3-phenylmethoxyphenyl)methyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxamide Traditional Name: 5-(3-benzoxybenzyl)-N-cyclopentyl-1-methyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxamide Formula: C27H33N4O2+ MolecularWeight: 445.57652

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C[NH+](CC2)CC3=CC(=CC=C3)OCC4=CC=CC=C4)C(=N1)C(=O)NC5CCCC5

Isomeric SMILES

CN1C2=C(C[NH+](CC2)CC3=CC(=CC=C3)OCC4=CC=CC=C4)C(=N1)C(=O)NC5CCCC5

InChI

InChI=1S/C27H32N4O2/c1-30-25-14-15-31(18-24(25)26(29-30)27(32)28-22-11-5-6-12-22)17-21-10-7-13-23(16-21)33-19-20-8-3-2-4-9-20/h2-4,7-10,13,16,22H,5-6,11-12,14-15,17-19H2,1H3,(H,28,32)/p+1