(4-chlorophenyl) (3S)-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxylate

Systemtic Name: (4-chlorophenyl) (3S)-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxylate Openeye Name: (4-chlorophenyl) (3S)-3-methyl-1-oxo-isochromane-3-carboxylate CAS Name: (3S)-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxylic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) (3S)-3-methyl-1-oxo-4H-isochromene-3-carboxylate Traditional Name: (3S)-1-keto-3-methyl-isochroman-3-carboxylic acid (4-chlorophenyl) ester Formula: C17H13ClO4 MolecularWeight: 316.73572

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=O)O1)C(=O)OC3=CC=C(C=C3)Cl

Isomeric SMILES

C[C@]1(CC2=CC=CC=C2C(=O)O1)C(=O)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H13ClO4/c1-17(16(20)21-13-8-6-12(18)7-9-13)10-11-4-2-3-5-14(11)15(19)22-17/h2-9H,10H2,1H3/t17-/m0/s1