1-(3,3-dimethyl-2-oxidanylidene-butyl)-5-phenyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 1-(3,3-dimethyl-2-oxidanylidene-butyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 1-(3,3-dimethyl-2-oxo-butyl)-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 1-(3,3-dimethyl-2-oxobutyl)-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 1-(3,3-dimethyl-2-oxobutyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 1-(2-keto-3,3-dimethyl-butyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C(=O)CN=C(C2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)CN1C(=O)CN=C(C2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O2/c1-21(2,3)18(24)14-23-17-12-8-7-11-16(17)20(22-13-19(23)25)15-9-5-4-6-10-15/h4-12H,13-14H2,1-3H3