4-(1,3-benzodioxol-5-ylcarbonyl)-7-bromanyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 4-(1,3-benzodioxol-5-ylcarbonyl)-7-bromanyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 4-(1,3-benzodioxole-5-carbonyl)-7-bromo-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 4-[1,3-benzodioxol-5-yl(oxo)methyl]-7-bromo-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 4-(1,3-benzodioxole-5-carbonyl)-7-bromo-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-5-phenyl-4-piperonyloyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C23H17BrN2O4 MolecularWeight: 465.29608

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(C=C(C=C2)Br)C(N1C(=O)C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

C1C(=O)NC2=C(C=C(C=C2)Br)C(N1C(=O)C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C23H17BrN2O4/c24-16-7-8-18-17(11-16)22(14-4-2-1-3-5-14)26(12-21(27)25-18)23(28)15-6-9-19-20(10-15)30-13-29-19/h1-11,22H,12-13H2,(H,25,27)