2-(5-chloranyl-1,3-benzoxazol-2-yl)-3-(1,2,4-triazol-4-ylamino)prop-2-enal

Systemtic Name: 2-(5-chloranyl-1,3-benzoxazol-2-yl)-3-(1,2,4-triazol-4-ylamino)prop-2-enal Openeye Name: 2-(5-chloro-1,3-benzoxazol-2-yl)-3-(1,2,4-triazol-4-ylamino)prop-2-enal CAS Name: 2-(5-chloro-1,3-benzoxazol-2-yl)-3-(1,2,4-triazol-4-ylamino)-2-propenal IUPAC Name: 2-(5-chloro-1,3-benzoxazol-2-yl)-3-(1,2,4-triazol-4-ylamino)prop-2-enal Traditional Name: 2-(5-chloro-1,3-benzoxazol-2-yl)-3-(1,2,4-triazol-4-ylamino)acrolein Formula: C12H8ClN5O2 MolecularWeight: 289.67722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N=C(O2)C(=CNN3C=NN=C3)C=O

Isomeric SMILES

C1=CC2=C(C=C1Cl)N=C(O2)C(=CNN3C=NN=C3)C=O

InChI

InChI=1S/C12H8ClN5O2/c13-9-1-2-11-10(3-9)17-12(20-11)8(5-19)4-16-18-6-14-15-7-18/h1-7,16H