N-[3,5-bis(trifluoromethyl)phenyl]-3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-(1-methylene-3-oxo-isoindolin-2-yl)propanamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-(1-methylene-3-oxo-2-isoindolyl)propanamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-(1-methylidene-3-oxoisoindol-2-yl)propanamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-(1-keto-3-methylene-isoindolin-2-yl)propionamide Formula: C20H14F6N2O2 MolecularWeight: 428.327779

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=CC=CC=C2C(=O)N1CCC(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C=C1C2=CC=CC=C2C(=O)N1CCC(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C20H14F6N2O2/c1-11-15-4-2-3-5-16(15)18(30)28(11)7-6-17(29)27-14-9-12(19(21,22)23)8-13(10-14)20(24,25)26/h2-5,8-10H,1,6-7H2,(H,27,29)