5-chloranyl-N-(6-ethanoyl-2,2-dimethyl-3-oxidanyl-4H-chromen-3-yl)-2-methoxy-benzamide

Systemtic Name: 5-chloranyl-N-(6-ethanoyl-2,2-dimethyl-3-oxidanyl-4H-chromen-3-yl)-2-methoxy-benzamide Openeye Name: N-(6-acetyl-3-hydroxy-2,2-dimethyl-chroman-3-yl)-5-chloro-2-methoxy-benzamide CAS Name: N-(6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-3-yl)-5-chloro-2-methoxybenzamide IUPAC Name: N-(6-acetyl-3-hydroxy-2,2-dimethyl-4H-chromen-3-yl)-5-chloro-2-methoxybenzamide Traditional Name: N-(6-acetyl-3-hydroxy-2,2-dimethyl-chroman-3-yl)-5-chloro-2-methoxy-benzamide Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OC(C(C2)(NC(=O)C3=C(C=CC(=C3)Cl)OC)O)(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OC(C(C2)(NC(=O)C3=C(C=CC(=C3)Cl)OC)O)(C)C

InChI

InChI=1S/C21H22ClNO5/c1-12(24)13-5-7-17-14(9-13)11-21(26,20(2,3)28-17)23-19(25)16-10-15(22)6-8-18(16)27-4/h5-10,26H,11H2,1-4H3,(H,23,25)