methyl 4-phenyl-2-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]carbonyloxymethyl]quinoline-3-carboxylate

Systemtic Name: methyl 4-phenyl-2-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]carbonyloxymethyl]quinoline-3-carboxylate Openeye Name: methyl 4-phenyl-2-[[2-(1,2,4-triazol-1-yl)pyridine-3-carbonyl]oxymethyl]quinoline-3-carboxylate CAS Name: 2-[[oxo-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]methoxy]methyl]-4-phenyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-phenyl-2-[[2-(1,2,4-triazol-1-yl)pyridine-3-carbonyl]oxymethyl]quinoline-3-carboxylate Traditional Name: 4-phenyl-2-[[2-(1,2,4-triazol-1-yl)nicotinoyl]oxymethyl]quinoline-3-carboxylic acid methyl ester Formula: C26H19N5O4 MolecularWeight: 465.46016

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3=C(N=CC=C3)N4C=NC=N4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3=C(N=CC=C3)N4C=NC=N4)C5=CC=CC=C5

InChI

InChI=1S/C26H19N5O4/c1-34-26(33)23-21(14-35-25(32)19-11-7-13-28-24(19)31-16-27-15-29-31)30-20-12-6-5-10-18(20)22(23)17-8-3-2-4-9-17/h2-13,15-16H,14H2,1H3