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

Systemtic Name: 4-[[(3R)-1-oxidanylidene-3-phenyl-3,4-dihydroisochromen-6-yl]carbonylamino]benzoate Openeye Name: 4-[[(3R)-1-oxo-3-phenyl-isochromane-6-carbonyl]amino]benzoate CAS Name: 4-[[oxo-[(3R)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-yl]methyl]amino]benzoate IUPAC Name: 4-[[(3R)-1-oxo-3-phenyl-3,4-dihydroisochromene-6-carbonyl]amino]benzoate Traditional Name: 4-[[(3R)-1-keto-3-phenyl-isochroman-6-carbonyl]amino]benzoate Formula: C23H16NO5- MolecularWeight: 386.37684

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1[C@@H](OC(=O)C2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C23H17NO5/c25-21(24-18-9-6-15(7-10-18)22(26)27)16-8-11-19-17(12-16)13-20(29-23(19)28)14-4-2-1-3-5-14/h1-12,20H,13H2,(H,24,25)(H,26,27)/p-1/t20-/m1/s1