dimethyl 2-[7-chloranyl-5-(2-chlorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-ylidene]propanedioate

Systemtic Name: dimethyl 2-[7-chloranyl-5-(2-chlorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-ylidene]propanedioate Openeye Name: dimethyl 2-[7-chloro-5-(2-chlorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-ylidene]propanedioate CAS Name: 2-[7-chloro-5-(2-chlorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-ylidene]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[7-chloro-5-(2-chlorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-ylidene]propanedioate Traditional Name: 2-[7-chloro-5-(2-chlorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-ylidene]malonic acid dimethyl ester Formula: C20H16Cl2N2O4 MolecularWeight: 419.25804

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C1CN=C(C2=C(N1)C=CC(=C2)Cl)C3=CC=CC=C3Cl)C(=O)OC

Isomeric SMILES

COC(=O)C(=C1CN=C(C2=C(N1)C=CC(=C2)Cl)C3=CC=CC=C3Cl)C(=O)OC

InChI

InChI=1S/C20H16Cl2N2O4/c1-27-19(25)17(20(26)28-2)16-10-23-18(12-5-3-4-6-14(12)22)13-9-11(21)7-8-15(13)24-16/h3-9,24H,10H2,1-2H3