4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-butanamide

Systemtic Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-butanamide Openeye Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(2-methoxy-5-methyl-phenyl)-4-oxo-butanamide CAS Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(2-methoxy-5-methylphenyl)-4-oxobutanamide IUPAC Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(2-methoxy-5-methylphenyl)-4-oxobutanamide Traditional Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-keto-N-(2-methoxy-5-methyl-phenyl)butyramide Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)CCC(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)CCC(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C21H23NO5/c1-14-4-7-18(25-2)16(12-14)22-21(24)9-6-17(23)15-5-8-19-20(13-15)27-11-3-10-26-19/h4-5,7-8,12-13H,3,6,9-11H2,1-2H3,(H,22,24)