[2-oxidanylidene-2-(propan-2-ylamino)ethyl] 4-(1,2,4-triazol-1-ylmethyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylamino)ethyl] 4-(1,2,4-triazol-1-ylmethyl)benzoate Openeye Name: [2-(isopropylamino)-2-oxo-ethyl] 4-(1,2,4-triazol-1-ylmethyl)benzoate CAS Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid [2-oxo-2-(propan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylamino)ethyl] 4-(1,2,4-triazol-1-ylmethyl)benzoate Traditional Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid [2-(isopropylamino)-2-keto-ethyl] ester Formula: C15H18N4O3 MolecularWeight: 302.32842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N4O3/c1-11(2)18-14(20)8-22-15(21)13-5-3-12(4-6-13)7-19-10-16-9-17-19/h3-6,9-11H,7-8H2,1-2H3,(H,18,20)