ethyl 5-cyclopentyl-1-(3-phenylpropyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxylate

Systemtic Name: ethyl 5-cyclopentyl-1-(3-phenylpropyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxylate Openeye Name: ethyl 5-cyclopentyl-1-(3-phenylpropyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxylate CAS Name: 5-cyclopentyl-1-(3-phenylpropyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyclopentyl-1-(3-phenylpropyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxylate Traditional Name: 5-cyclopentyl-1-(3-phenylpropyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxylic acid ethyl ester Formula: C23H32N3O2+ MolecularWeight: 382.51908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1C[NH+](CC2)C3CCCC3)CCCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1C[NH+](CC2)C3CCCC3)CCCC4=CC=CC=C4

InChI

InChI=1S/C23H31N3O2/c1-2-28-23(27)22-20-17-25(19-12-6-7-13-19)16-14-21(20)26(24-22)15-8-11-18-9-4-3-5-10-18/h3-5,9-10,19H,2,6-8,11-17H2,1H3/p+1