(3S)-N-[(1S)-1-(3,4-dichlorophenyl)ethyl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: (3S)-N-[(1S)-1-(3,4-dichlorophenyl)ethyl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: (3S)-N-[(1S)-1-(3,4-dichlorophenyl)ethyl]-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: (3S)-N-[(1S)-1-(3,4-dichlorophenyl)ethyl]-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-N-[(1S)-1-(3,4-dichlorophenyl)ethyl]-3-methyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: (3S)-N-[(1S)-1-(3,4-dichlorophenyl)ethyl]-1-keto-3-methyl-isochroman-3-carboxamide Formula: C19H17Cl2NO3 MolecularWeight: 378.24918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)Cl)Cl)NC(=O)C2(CC3=CC=CC=C3C(=O)O2)C

Isomeric SMILES

C[C@@H](C1=CC(=C(C=C1)Cl)Cl)NC(=O)[C@@]2(CC3=CC=CC=C3C(=O)O2)C

InChI

InChI=1S/C19H17Cl2NO3/c1-11(12-7-8-15(20)16(21)9-12)22-18(24)19(2)10-13-5-3-4-6-14(13)17(23)25-19/h3-9,11H,10H2,1-2H3,(H,22,24)/t11-,19-/m0/s1