ethanedioic acid; (4E)-1-phenyl-4-(2-piperidin-1-ylethylidene)-6,7-dihydro-5H-indazole

Systemtic Name: ethanedioic acid; (4E)-1-phenyl-4-(2-piperidin-1-ylethylidene)-6,7-dihydro-5H-indazole Openeye Name: oxalic acid; (4E)-1-phenyl-4-[2-(1-piperidyl)ethylidene]-6,7-dihydro-5H-indazole CAS Name: oxalic acid; (4E)-1-phenyl-4-[2-(1-piperidinyl)ethylidene]-6,7-dihydro-5H-indazole IUPAC Name: oxalic acid; (4E)-1-phenyl-4-(2-piperidin-1-ylethylidene)-6,7-dihydro-5H-indazole Traditional Name: oxalic acid; (4E)-1-phenyl-4-(2-piperidinoethylidene)-6,7-dihydro-5H-indazole Formula: C22H27N3O4 MolecularWeight: 397.46748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC=C2CCCC3=C2C=NN3C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)C/C=C/2\CCCC3=C2C=NN3C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H25N3.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/h1,3-4,9-10,12,16H,2,5-8,11,13-15H2;(H,3,4)(H,5,6)/b17-12+;