4-[[7-bromanyl-5-(2-chlorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]oxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[7-bromanyl-5-(2-chlorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]oxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[7-bromo-5-(2-chlorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]oxy]-4-oxo-butanoic acid CAS Name: 4-[[7-bromo-5-(2-chlorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]oxy]-4-oxobutanoic acid IUPAC Name: 4-[[7-bromo-5-(2-chlorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]oxy]-4-oxobutanoic acid Traditional Name: 4-[[7-bromo-5-(2-chlorophenyl)-2-keto-1-methyl-3H-1,4-benzodiazepin-3-yl]oxy]-4-keto-butyric acid Formula: C20H16BrClN2O5 MolecularWeight: 479.70844

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Br)C(=NC(C1=O)OC(=O)CCC(=O)O)C3=CC=CC=C3Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2)Br)C(=NC(C1=O)OC(=O)CCC(=O)O)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H16BrClN2O5/c1-24-15-7-6-11(21)10-13(15)18(12-4-2-3-5-14(12)22)23-19(20(24)28)29-17(27)9-8-16(25)26/h2-7,10,19H,8-9H2,1H3,(H,25,26)