N-(3-chloranyl-2-morpholin-4-yl-phenyl)-3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanamide

Systemtic Name: N-(3-chloranyl-2-morpholin-4-yl-phenyl)-3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanamide Openeye Name: N-(3-chloro-2-morpholino-phenyl)-3-(1-methylene-3-oxo-isoindolin-2-yl)propanamide CAS Name: N-[3-chloro-2-(4-morpholinyl)phenyl]-3-(1-methylene-3-oxo-2-isoindolyl)propanamide IUPAC Name: N-(3-chloro-2-morpholin-4-ylphenyl)-3-(1-methylidene-3-oxoisoindol-2-yl)propanamide Traditional Name: N-(3-chloro-2-morpholino-phenyl)-3-(1-keto-3-methylene-isoindolin-2-yl)propionamide Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=CC=CC=C2C(=O)N1CCC(=O)NC3=C(C(=CC=C3)Cl)N4CCOCC4

Isomeric SMILES

C=C1C2=CC=CC=C2C(=O)N1CCC(=O)NC3=C(C(=CC=C3)Cl)N4CCOCC4

InChI

InChI=1S/C22H22ClN3O3/c1-15-16-5-2-3-6-17(16)22(28)26(15)10-9-20(27)24-19-8-4-7-18(23)21(19)25-11-13-29-14-12-25/h2-8H,1,9-14H2,(H,24,27)