sulfuric acid; 2,4,7,8-tetramethyl-3H-1,5-benzodiazepine

Systemtic Name: sulfuric acid; 2,4,7,8-tetramethyl-3H-1,5-benzodiazepine Openeye Name: sulfuric acid; 2,4,7,8-tetramethyl-3H-1,5-benzodiazepine CAS Name: sulfuric acid; 2,4,7,8-tetramethyl-3H-1,5-benzodiazepine IUPAC Name: sulfuric acid; 2,4,7,8-tetramethyl-3H-1,5-benzodiazepine Traditional Name: sulfuric acid; 2,4,7,8-tetramethyl-3H-1,5-benzodiazepine Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C(=C2)C)C)N=C(C1)C.OS(=O)(=O)O

Isomeric SMILES

CC1=NC2=C(C=C(C(=C2)C)C)N=C(C1)C.OS(=O)(=O)O

InChI

InChI=1S/C13H16N2.H2O4S/c1-8-5-12-13(6-9(8)2)15-11(4)7-10(3)14-12;1-5(2,3)4/h5-6H,7H2,1-4H3;(H2,1,2,3,4)