3-[(2R)-2-naphthalen-2-yl-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]chromen-2-one

Systemtic Name: 3-[(2R)-2-naphthalen-2-yl-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]chromen-2-one Openeye Name: 3-[(2R)-2-(2-naphthyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]chromen-2-one CAS Name: 3-[(2R)-2-(2-naphthalenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]-1-benzopyran-2-one IUPAC Name: 3-[(2R)-2-naphthalen-2-yl-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]chromen-2-one Traditional Name: 3-[(2R)-2-(2-naphthyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]coumarin Formula: C28H20N2O2 MolecularWeight: 416.4706

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC2=CC=CC=C2N=C1C3=CC4=CC=CC=C4OC3=O)C5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C1[C@@H](NC2=CC=CC=C2N=C1C3=CC4=CC=CC=C4OC3=O)C5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C28H20N2O2/c31-28-22(16-21-9-3-6-12-27(21)32-28)26-17-25(29-23-10-4-5-11-24(23)30-26)20-14-13-18-7-1-2-8-19(18)15-20/h1-16,25,29H,17H2/t25-/m1/s1