methyl 4-[[[1-(oxolan-2-ylmethyl)-1,2,3-triazol-4-yl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[1-(oxolan-2-ylmethyl)-1,2,3-triazol-4-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[1-(tetrahydrofuran-2-ylmethyl)triazole-4-carbonyl]amino]methyl]benzoate CAS Name: 4-[[[oxo-[1-(2-oxolanylmethyl)-4-triazolyl]methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[1-(oxolan-2-ylmethyl)triazole-4-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[[1-(tetrahydrofurfuryl)triazole-4-carbonyl]amino]methyl]benzoic acid methyl ester Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CN(N=N2)CC3CCCO3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CN(N=N2)CC3CCCO3

InChI

InChI=1S/C17H20N4O4/c1-24-17(23)13-6-4-12(5-7-13)9-18-16(22)15-11-21(20-19-15)10-14-3-2-8-25-14/h4-7,11,14H,2-3,8-10H2,1H3,(H,18,22)