ethanedioic acid; 1-phenyl-4-(2-piperidin-1-ylethyl)-4,5,6,7-tetrahydroindazole

Systemtic Name: ethanedioic acid; 1-phenyl-4-(2-piperidin-1-ylethyl)-4,5,6,7-tetrahydroindazole Openeye Name: oxalic acid; 1-phenyl-4-[2-(1-piperidyl)ethyl]-4,5,6,7-tetrahydroindazole CAS Name: oxalic acid; 1-phenyl-4-[2-(1-piperidinyl)ethyl]-4,5,6,7-tetrahydroindazole IUPAC Name: oxalic acid; 1-phenyl-4-(2-piperidin-1-ylethyl)-4,5,6,7-tetrahydroindazole Traditional Name: oxalic acid; 1-phenyl-4-(2-piperidinoethyl)-4,5,6,7-tetrahydroindazole Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC2CCCC3=C2C=NN3C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)CCC2CCCC3=C2C=NN3C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H27N3.C2H2O4/c1-3-9-18(10-4-1)23-20-11-7-8-17(19(20)16-21-23)12-15-22-13-5-2-6-14-22;3-1(4)2(5)6/h1,3-4,9-10,16-17H,2,5-8,11-15H2;(H,3,4)(H,5,6)