(3S)-1-oxidanylidene-3-phenyl-N-[3-[(E)-2-pyridin-2-ylethenyl]phenyl]-3,4-dihydroisochromene-6-carboxamide

Systemtic Name: (3S)-1-oxidanylidene-3-phenyl-N-[3-[(E)-2-pyridin-2-ylethenyl]phenyl]-3,4-dihydroisochromene-6-carboxamide Openeye Name: (3S)-1-oxo-3-phenyl-N-[3-[(E)-2-(2-pyridyl)vinyl]phenyl]isochromane-6-carboxamide CAS Name: (3S)-1-oxo-3-phenyl-N-[3-[(E)-2-(2-pyridinyl)ethenyl]phenyl]-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: (3S)-1-oxo-3-phenyl-N-[3-[(E)-2-pyridin-2-ylethenyl]phenyl]-3,4-dihydroisochromene-6-carboxamide Traditional Name: (3S)-1-keto-3-phenyl-N-[3-[(E)-2-(2-pyridyl)vinyl]phenyl]isochroman-6-carboxamide Formula: C29H22N2O3 MolecularWeight: 446.49658

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=C1C=C(C=C2)C(=O)NC3=CC=CC(=C3)C=CC4=CC=CC=N4)C5=CC=CC=C5

Isomeric SMILES

C1[C@H](OC(=O)C2=C1C=C(C=C2)C(=O)NC3=CC=CC(=C3)/C=C/C4=CC=CC=N4)C5=CC=CC=C5

InChI

InChI=1S/C29H22N2O3/c32-28(31-25-11-6-7-20(17-25)12-14-24-10-4-5-16-30-24)22-13-15-26-23(18-22)19-27(34-29(26)33)21-8-2-1-3-9-21/h1-18,27H,19H2,(H,31,32)/b14-12+/t27-/m0/s1