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

Systemtic Name: (3S)-N-(2-ethyl-6-methyl-phenyl)-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide Openeye Name: (3S)-N-(2-ethyl-6-methyl-phenyl)-1-oxo-3-phenyl-isochromane-6-carboxamide CAS Name: (3S)-N-(2-ethyl-6-methylphenyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: (3S)-N-(2-ethyl-6-methylphenyl)-1-oxo-3-phenyl-3,4-dihydroisochromene-6-carboxamide Traditional Name: (3S)-N-(2-ethyl-6-methyl-phenyl)-1-keto-3-phenyl-isochroman-6-carboxamide Formula: C25H23NO3 MolecularWeight: 385.45502

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2=CC3=C(C=C2)C(=O)O[C@@H](C3)C4=CC=CC=C4)C

InChI

InChI=1S/C25H23NO3/c1-3-17-11-7-8-16(2)23(17)26-24(27)19-12-13-21-20(14-19)15-22(29-25(21)28)18-9-5-4-6-10-18/h4-14,22H,3,15H2,1-2H3,(H,26,27)/t22-/m0/s1