methyl (3R,4S)-3-(1H-indol-3-yl)-1-oxidanylidene-3,4-dihydroisochromene-4-carboxylate

Systemtic Name: methyl (3R,4S)-3-(1H-indol-3-yl)-1-oxidanylidene-3,4-dihydroisochromene-4-carboxylate Openeye Name: methyl (3R,4S)-3-(1H-indol-3-yl)-1-oxo-isochromane-4-carboxylate CAS Name: (3R,4S)-3-(1H-indol-3-yl)-1-oxo-3,4-dihydro-1H-2-benzopyran-4-carboxylic acid methyl ester IUPAC Name: methyl (3R,4S)-3-(1H-indol-3-yl)-1-oxo-3,4-dihydroisochromene-4-carboxylate Traditional Name: (3R,4S)-3-(1H-indol-3-yl)-1-keto-isochroman-4-carboxylic acid methyl ester Formula: C19H15NO4 MolecularWeight: 321.3267

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(OC(=O)C2=CC=CC=C12)C3=CNC4=CC=CC=C43

Isomeric SMILES

COC(=O)[C@@H]1[C@@H](OC(=O)C2=CC=CC=C12)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C19H15NO4/c1-23-19(22)16-12-7-2-3-8-13(12)18(21)24-17(16)14-10-20-15-9-5-4-6-11(14)15/h2-10,16-17,20H,1H3/t16-,17-/m0/s1