3-azido-7,8-bis(chloranyl)-1-(3-methyl-2-oxidanylidene-butyl)-5-phenyl-1,5-benzodiazepine-2,4-dione

Systemtic Name: 3-azido-7,8-bis(chloranyl)-1-(3-methyl-2-oxidanylidene-butyl)-5-phenyl-1,5-benzodiazepine-2,4-dione Openeye Name: 3-azido-7,8-dichloro-1-(3-methyl-2-oxo-butyl)-5-phenyl-1,5-benzodiazepine-2,4-dione CAS Name: 3-azido-7,8-dichloro-1-(3-methyl-2-oxobutyl)-5-phenyl-1,5-benzodiazepine-2,4-dione IUPAC Name: 3-azido-7,8-dichloro-1-(3-methyl-2-oxobutyl)-5-phenyl-1,5-benzodiazepine-2,4-dione Traditional Name: 3-azido-7,8-dichloro-1-(2-keto-3-methyl-butyl)-5-phenyl-1,5-benzodiazepine-2,4-quinone Formula: C20H17Cl2N5O3 MolecularWeight: 446.28668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)CN1C2=CC(=C(C=C2N(C(=O)C(C1=O)N=[N+]=[N-])C3=CC=CC=C3)Cl)Cl

Isomeric SMILES

CC(C)C(=O)CN1C2=CC(=C(C=C2N(C(=O)C(C1=O)N=[N+]=[N-])C3=CC=CC=C3)Cl)Cl

InChI

InChI=1S/C20H17Cl2N5O3/c1-11(2)17(28)10-26-15-8-13(21)14(22)9-16(15)27(12-6-4-3-5-7-12)20(30)18(19(26)29)24-25-23/h3-9,11,18H,10H2,1-2H3