ethyl 1-[3-(3-methyl-2H-indazol-5-yl)-1,2,4-triazin-5-yl]-3-(phenylmethyl)piperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-(3-methyl-2H-indazol-5-yl)-1,2,4-triazin-5-yl]-3-(phenylmethyl)piperidine-3-carboxylate Openeye Name: ethyl 3-benzyl-1-[3-(3-methyl-2H-indazol-5-yl)-1,2,4-triazin-5-yl]piperidine-3-carboxylate CAS Name: 1-[3-(3-methyl-2H-indazol-5-yl)-1,2,4-triazin-5-yl]-3-(phenylmethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzyl-1-[3-(3-methyl-2H-indazol-5-yl)-1,2,4-triazin-5-yl]piperidine-3-carboxylate Traditional Name: 3-benzyl-1-[3-(3-methyl-2H-indazol-5-yl)-1,2,4-triazin-5-yl]nipecotic acid ethyl ester Formula: C26H28N6O2 MolecularWeight: 456.53952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C2=CN=NC(=N2)C3=CC4=C(NN=C4C=C3)C)CC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C2=CN=NC(=N2)C3=CC4=C(NN=C4C=C3)C)CC5=CC=CC=C5

InChI

InChI=1S/C26H28N6O2/c1-3-34-25(33)26(15-19-8-5-4-6-9-19)12-7-13-32(17-26)23-16-27-31-24(28-23)20-10-11-22-21(14-20)18(2)29-30-22/h4-6,8-11,14,16H,3,7,12-13,15,17H2,1-2H3,(H,29,30)