3-(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-(1H-1,2,4-triazol-5-yl)propanimidate

Systemtic Name: 3-(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-(1H-1,2,4-triazol-5-yl)propanimidate Openeye Name: 3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-(1H-1,2,4-triazol-5-yl)propanimidate CAS Name: 3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-(1H-1,2,4-triazol-5-yl)propanimidate IUPAC Name: 3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-(1H-1,2,4-triazol-5-yl)propanimidate Traditional Name: 3-(6-chloro-2-keto-1,3-benzoxazol-3-yl)-N-(1H-1,2,4-triazol-5-yl)propionimidate Formula: C12H9ClN5O3- MolecularWeight: 306.68456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)OC(=O)N2CCC(=NC3=NC=NN3)[O-]

Isomeric SMILES

C1=CC2=C(C=C1Cl)OC(=O)N2CCC(=NC3=NC=NN3)[O-]

InChI

InChI=1S/C12H10ClN5O3/c13-7-1-2-8-9(5-7)21-12(20)18(8)4-3-10(19)16-11-14-6-15-17-11/h1-2,5-6H,3-4H2,(H2,14,15,16,17,19)/p-1