(5S)-4-(1,3-benzodioxol-5-ylcarbonyl)-8-chloranyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: (5S)-4-(1,3-benzodioxol-5-ylcarbonyl)-8-chloranyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: (5S)-4-(1,3-benzodioxole-5-carbonyl)-8-chloro-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: (5S)-4-[1,3-benzodioxol-5-yl(oxo)methyl]-8-chloro-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: (5S)-4-(1,3-benzodioxole-5-carbonyl)-8-chloro-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: (5S)-8-chloro-5-phenyl-4-piperonyloyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C23H17ClN2O4 MolecularWeight: 420.84508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1C(=O)NC2=C(C=CC(=C2)Cl)[C@@H](N1C(=O)C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C23H17ClN2O4/c24-16-7-8-17-18(11-16)25-21(27)12-26(22(17)14-4-2-1-3-5-14)23(28)15-6-9-19-20(10-15)30-13-29-19/h1-11,22H,12-13H2,(H,25,27)/t22-/m0/s1