N-(5-chloranyl-2,4-dimethoxy-phenyl)-3-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)sulfonyl]butanamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-3-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)sulfonyl]butanamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-3-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonyl]butanamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-3-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonyl]butanamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-3-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonyl]butanamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-3-[(3-keto-4H-1,4-benzoxazin-6-yl)sulfonyl]butyramide Formula: C20H21ClN2O7S MolecularWeight: 468.90794

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC(=C(C=C1OC)OC)Cl)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3

Isomeric SMILES

CC(CC(=O)NC1=CC(=C(C=C1OC)OC)Cl)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3

InChI

InChI=1S/C20H21ClN2O7S/c1-11(6-19(24)22-15-8-13(21)17(28-2)9-18(15)29-3)31(26,27)12-4-5-16-14(7-12)23-20(25)10-30-16/h4-5,7-9,11H,6,10H2,1-3H3,(H,22,24)(H,23,25)