ethyl 1-(5-naphthalen-1-yl-1,2,4-triazin-3-yl)piperidine-3-carboxylate

Systemtic Name: ethyl 1-(5-naphthalen-1-yl-1,2,4-triazin-3-yl)piperidine-3-carboxylate Openeye Name: ethyl 1-[5-(1-naphthyl)-1,2,4-triazin-3-yl]piperidine-3-carboxylate CAS Name: 1-[5-(1-naphthalenyl)-1,2,4-triazin-3-yl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(5-naphthalen-1-yl-1,2,4-triazin-3-yl)piperidine-3-carboxylate Traditional Name: 1-[5-(1-naphthyl)-1,2,4-triazin-3-yl]nipecotic acid ethyl ester Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=NC(=CN=N2)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C2=NC(=CN=N2)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H22N4O2/c1-2-27-20(26)16-9-6-12-25(14-16)21-23-19(13-22-24-21)18-11-5-8-15-7-3-4-10-17(15)18/h3-5,7-8,10-11,13,16H,2,6,9,12,14H2,1H3