ethanedioic acid; N-[2-[4-(2-phenylethanoylamino)piperidin-1-yl]ethyl]-1-propan-2-yl-indazole-3-carboxamide

Systemtic Name: ethanedioic acid; N-[2-[4-(2-phenylethanoylamino)piperidin-1-yl]ethyl]-1-propan-2-yl-indazole-3-carboxamide Openeye Name: 1-isopropyl-N-[2-[4-[(2-phenylacetyl)amino]-1-piperidyl]ethyl]indazole-3-carboxamide; oxalic acid CAS Name: oxalic acid; N-[2-[4-[(1-oxo-2-phenylethyl)amino]-1-piperidinyl]ethyl]-1-propan-2-yl-3-indazolecarboxamide IUPAC Name: oxalic acid; N-[2-[4-[(2-phenylacetyl)amino]piperidin-1-yl]ethyl]-1-propan-2-ylindazole-3-carboxamide Traditional Name: 1-isopropyl-N-[2-[4-[(2-phenylacetyl)amino]piperidino]ethyl]indazole-3-carboxamide; oxalic acid Formula: C28H35N5O6 MolecularWeight: 537.6074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=CC=CC=C2C(=N1)C(=O)NCCN3CCC(CC3)NC(=O)CC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)N1C2=CC=CC=C2C(=N1)C(=O)NCCN3CCC(CC3)NC(=O)CC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C26H33N5O2.C2H2O4/c1-19(2)31-23-11-7-6-10-22(23)25(29-31)26(33)27-14-17-30-15-12-21(13-16-30)28-24(32)18-20-8-4-3-5-9-20;3-1(4)2(5)6/h3-11,19,21H,12-18H2,1-2H3,(H,27,33)(H,28,32);(H,3,4)(H,5,6)