(3S)-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: (3S)-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: (3S)-N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: (3S)-N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: (3S)-N-[2-chloro-5-(trifluoromethyl)phenyl]-1-keto-3-methyl-isochroman-3-carboxamide Formula: C18H13ClF3NO3 MolecularWeight: 383.74893

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

C[C@]1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C18H13ClF3NO3/c1-17(9-10-4-2-3-5-12(10)15(24)26-17)16(25)23-14-8-11(18(20,21)22)6-7-13(14)19/h2-8H,9H2,1H3,(H,23,25)/t17-/m0/s1