N-(5-chloranyl-2,4-dimethoxy-phenyl)-3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-3-(4-keto-1,2,3-benzotriazin-3-yl)propionamide Formula: C18H17ClN4O4 MolecularWeight: 388.80498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CCN2C(=O)C3=CC=CC=C3N=N2)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CCN2C(=O)C3=CC=CC=C3N=N2)Cl)OC

InChI

InChI=1S/C18H17ClN4O4/c1-26-15-10-16(27-2)14(9-12(15)19)20-17(24)7-8-23-18(25)11-5-3-4-6-13(11)21-22-23/h3-6,9-10H,7-8H2,1-2H3,(H,20,24)