6-chloranyl-4-(3,3-dimethyl-2-oxidanylidene-butyl)-1-(phenylmethyl)quinoxaline-2,3-dione

Systemtic Name: 6-chloranyl-4-(3,3-dimethyl-2-oxidanylidene-butyl)-1-(phenylmethyl)quinoxaline-2,3-dione Openeye Name: 1-benzyl-6-chloro-4-(3,3-dimethyl-2-oxo-butyl)quinoxaline-2,3-dione CAS Name: 6-chloro-4-(3,3-dimethyl-2-oxobutyl)-1-(phenylmethyl)quinoxaline-2,3-dione IUPAC Name: 1-benzyl-6-chloro-4-(3,3-dimethyl-2-oxobutyl)quinoxaline-2,3-dione Traditional Name: 1-benzyl-6-chloro-4-(2-keto-3,3-dimethyl-butyl)quinoxaline-2,3-quinone Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C2=C(C=CC(=C2)Cl)N(C(=O)C1=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)CN1C2=C(C=CC(=C2)Cl)N(C(=O)C1=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H21ClN2O3/c1-21(2,3)18(25)13-24-17-11-15(22)9-10-16(17)23(19(26)20(24)27)12-14-7-5-4-6-8-14/h4-11H,12-13H2,1-3H3