6-chloranyl-2-(3,4-dimethoxyphenyl)-N-(1H-1,2,4-triazol-5-yl)chromen-4-imine

Systemtic Name: 6-chloranyl-2-(3,4-dimethoxyphenyl)-N-(1H-1,2,4-triazol-5-yl)chromen-4-imine Openeye Name: 6-chloro-2-(3,4-dimethoxyphenyl)-N-(1H-1,2,4-triazol-5-yl)chromen-4-imine CAS Name: 6-chloro-2-(3,4-dimethoxyphenyl)-N-(1H-1,2,4-triazol-5-yl)-1-benzopyran-4-imine IUPAC Name: 6-chloro-2-(3,4-dimethoxyphenyl)-N-(1H-1,2,4-triazol-5-yl)chromen-4-imine Traditional Name: (E)-[6-chloro-2-(3,4-dimethoxyphenyl)chromen-4-ylidene]-(1H-1,2,4-triazol-5-yl)amine Formula: C19H15ClN4O3 MolecularWeight: 382.8004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NC3=NC=NN3)C4=C(O2)C=CC(=C4)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C/C(=N\C3=NC=NN3)/C4=C(O2)C=CC(=C4)Cl)OC

InChI

InChI=1S/C19H15ClN4O3/c1-25-16-5-3-11(7-18(16)26-2)17-9-14(23-19-21-10-22-24-19)13-8-12(20)4-6-15(13)27-17/h3-10H,1-2H3,(H,21,22,24)/b23-14+