methyl 4-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]carbonylamino]butanoate Openeye Name: methyl 4-[[4-(1,2,4-triazol-1-ylmethyl)benzoyl]amino]butanoate CAS Name: 4-[[oxo-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[4-(1,2,4-triazol-1-ylmethyl)benzoyl]amino]butanoate Traditional Name: 4-[[4-(1,2,4-triazol-1-ylmethyl)benzoyl]amino]butyric acid methyl ester Formula: C15H18N4O3 MolecularWeight: 302.32842

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)C1=CC=C(C=C1)CN2C=NC=N2

Isomeric SMILES

COC(=O)CCCNC(=O)C1=CC=C(C=C1)CN2C=NC=N2

InChI

InChI=1S/C15H18N4O3/c1-22-14(20)3-2-8-17-15(21)13-6-4-12(5-7-13)9-19-11-16-10-18-19/h4-7,10-11H,2-3,8-9H2,1H3,(H,17,21)