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

Systemtic Name: 3-[2-(4-methylphenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]chromen-2-one Openeye Name: 3-[2-(p-tolyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]chromen-2-one CAS Name: 3-[2-(4-methylphenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]-1-benzopyran-2-one IUPAC Name: 3-[2-(4-methylphenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]chromen-2-one Traditional Name: 3-[2-(p-tolyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]coumarin Formula: C25H20N2O2 MolecularWeight: 380.4385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=NC3=CC=CC=C3N2)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=NC3=CC=CC=C3N2)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C25H20N2O2/c1-16-10-12-17(13-11-16)22-15-23(27-21-8-4-3-7-20(21)26-22)19-14-18-6-2-5-9-24(18)29-25(19)28/h2-14,22,26H,15H2,1H3