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

Systemtic Name: 3-[2-(4-nitrophenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]chromen-2-one Openeye Name: 3-[2-(4-nitrophenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]chromen-2-one CAS Name: 3-[2-(4-nitrophenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]-1-benzopyran-2-one IUPAC Name: 3-[2-(4-nitrophenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]chromen-2-one Traditional Name: 3-[2-(4-nitrophenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]coumarin Formula: C24H17N3O4 MolecularWeight: 411.40948

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC2=CC=CC=C2N=C1C3=CC4=CC=CC=C4OC3=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1C(NC2=CC=CC=C2N=C1C3=CC4=CC=CC=C4OC3=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C24H17N3O4/c28-24-18(13-16-5-1-4-8-23(16)31-24)22-14-21(15-9-11-17(12-10-15)27(29)30)25-19-6-2-3-7-20(19)26-22/h1-13,21,25H,14H2