4-tert-butyl-7-chloranyl-1-[(4-methoxyphenyl)methyl]-3H-1,4-benzodiazepine-2,5-dione

Systemtic Name: 4-tert-butyl-7-chloranyl-1-[(4-methoxyphenyl)methyl]-3H-1,4-benzodiazepine-2,5-dione Openeye Name: 4-tert-butyl-7-chloro-1-[(4-methoxyphenyl)methyl]-3H-1,4-benzodiazepine-2,5-dione CAS Name: 4-tert-butyl-7-chloro-1-[(4-methoxyphenyl)methyl]-3H-1,4-benzodiazepine-2,5-dione IUPAC Name: 4-tert-butyl-7-chloro-1-[(4-methoxyphenyl)methyl]-3H-1,4-benzodiazepine-2,5-dione Traditional Name: 4-tert-butyl-7-chloro-1-p-anisyl-3H-1,4-benzodiazepine-2,5-quinone Formula: C21H23ClN2O3 MolecularWeight: 386.87192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CC(=O)N(C2=C(C1=O)C=C(C=C2)Cl)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)N1CC(=O)N(C2=C(C1=O)C=C(C=C2)Cl)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H23ClN2O3/c1-21(2,3)24-13-19(25)23(12-14-5-8-16(27-4)9-6-14)18-10-7-15(22)11-17(18)20(24)26/h5-11H,12-13H2,1-4H3