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

Systemtic Name: N-(2-chloranyl-4,5-dimethoxy-phenyl)-3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanamide Openeye Name: N-(2-chloro-4,5-dimethoxy-phenyl)-3-(1-methylene-3-oxo-isoindolin-2-yl)propanamide CAS Name: N-(2-chloro-4,5-dimethoxyphenyl)-3-(1-methylene-3-oxo-2-isoindolyl)propanamide IUPAC Name: N-(2-chloro-4,5-dimethoxyphenyl)-3-(1-methylidene-3-oxoisoindol-2-yl)propanamide Traditional Name: N-(2-chloro-4,5-dimethoxy-phenyl)-3-(1-keto-3-methylene-isoindolin-2-yl)propionamide Formula: C20H19ClN2O4 MolecularWeight: 386.82886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NC(=O)CCN2C(=C)C3=CC=CC=C3C2=O)Cl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)NC(=O)CCN2C(=C)C3=CC=CC=C3C2=O)Cl)OC

InChI

InChI=1S/C20H19ClN2O4/c1-12-13-6-4-5-7-14(13)20(25)23(12)9-8-19(24)22-16-11-18(27-3)17(26-2)10-15(16)21/h4-7,10-11H,1,8-9H2,2-3H3,(H,22,24)