(3S)-N-(2-methyl-1,3-benzoxazol-5-yl)-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide

Systemtic Name: (3S)-N-(2-methyl-1,3-benzoxazol-5-yl)-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide Openeye Name: (3S)-N-(2-methyl-1,3-benzoxazol-5-yl)-1-oxo-3-phenyl-isochromane-6-carboxamide CAS Name: (3S)-N-(2-methyl-1,3-benzoxazol-5-yl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: (3S)-N-(2-methyl-1,3-benzoxazol-5-yl)-1-oxo-3-phenyl-3,4-dihydroisochromene-6-carboxamide Traditional Name: (3S)-1-keto-N-(2-methyl-1,3-benzoxazol-5-yl)-3-phenyl-isochroman-6-carboxamide Formula: C24H18N2O4 MolecularWeight: 398.41072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(O1)C=CC(=C2)NC(=O)C3=CC4=C(C=C3)C(=O)OC(C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=C(O1)C=CC(=C2)NC(=O)C3=CC4=C(C=C3)C(=O)O[C@@H](C4)C5=CC=CC=C5

InChI

InChI=1S/C24H18N2O4/c1-14-25-20-13-18(8-10-21(20)29-14)26-23(27)16-7-9-19-17(11-16)12-22(30-24(19)28)15-5-3-2-4-6-15/h2-11,13,22H,12H2,1H3,(H,26,27)/t22-/m0/s1