(3R)-6-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]carbonyl-3-phenyl-3,4-dihydroisochromen-1-one

Systemtic Name: (3R)-6-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]carbonyl-3-phenyl-3,4-dihydroisochromen-1-one Openeye Name: (3R)-6-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-3-phenyl-isochroman-1-one CAS Name: (3R)-6-[[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-oxomethyl]-3-phenyl-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: (3R)-6-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-3-phenyl-3,4-dihydroisochromen-1-one Traditional Name: (3R)-6-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]-3-phenyl-isochroman-1-one Formula: C28H24N2O4 MolecularWeight: 452.50116

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3O2)C(=O)C4=CC5=C(C=C4)C(=O)OC(C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3O2)C(=O)C4=CC5=C(C=C4)C(=O)O[C@H](C5)C6=CC=CC=C6

InChI

InChI=1S/C28H24N2O4/c31-27(30-14-12-19(13-15-30)26-29-23-8-4-5-9-24(23)33-26)20-10-11-22-21(16-20)17-25(34-28(22)32)18-6-2-1-3-7-18/h1-11,16,19,25H,12-15,17H2/t25-/m1/s1