N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-butanamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-butanamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(2-methoxy-5-methyl-phenyl)-4-oxo-butanamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(2-methoxy-5-methylphenyl)-4-oxobutanamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-(2-methoxy-5-methylphenyl)-4-oxobutanamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-keto-4-(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)C(=O)CCC(=O)NC(C)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(=O)CCC(=O)NC(C)C2=CC3=C(C=C2)OCO3

InChI

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