methyl 2-[[(3R)-6-chloranyl-1-oxidanylidene-3,4-dihydroisochromen-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[(3R)-6-chloranyl-1-oxidanylidene-3,4-dihydroisochromen-3-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[(3R)-6-chloro-1-oxo-isochromane-3-carbonyl]amino]benzoate CAS Name: 2-[[[(3R)-6-chloro-1-oxo-3,4-dihydro-1H-2-benzopyran-3-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(3R)-6-chloro-1-oxo-3,4-dihydroisochromene-3-carbonyl]amino]benzoate Traditional Name: 2-[[(3R)-6-chloro-1-keto-isochroman-3-carbonyl]amino]benzoic acid methyl ester Formula: C18H14ClNO5 MolecularWeight: 359.76046

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2CC3=C(C=CC(=C3)Cl)C(=O)O2

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)[C@H]2CC3=C(C=CC(=C3)Cl)C(=O)O2

InChI

InChI=1S/C18H14ClNO5/c1-24-17(22)13-4-2-3-5-14(13)20-16(21)15-9-10-8-11(19)6-7-12(10)18(23)25-15/h2-8,15H,9H2,1H3,(H,20,21)/t15-/m1/s1