2-methyl-4-phenyl-3H-1,5-benzodiazepine; sulfuric acid

Systemtic Name: 2-methyl-4-phenyl-3H-1,5-benzodiazepine; sulfuric acid Openeye Name: 2-methyl-4-phenyl-3H-1,5-benzodiazepine; sulfuric acid CAS Name: 2-methyl-4-phenyl-3H-1,5-benzodiazepine; sulfuric acid IUPAC Name: 2-methyl-4-phenyl-3H-1,5-benzodiazepine; sulfuric acid Traditional Name: 2-methyl-4-phenyl-3H-1,5-benzodiazepine; sulfuric acid Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C(C1)C3=CC=CC=C3.OS(=O)(=O)O

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C(C1)C3=CC=CC=C3.OS(=O)(=O)O

InChI

InChI=1S/C16H14N2.H2O4S/c1-12-11-16(13-7-3-2-4-8-13)18-15-10-6-5-9-14(15)17-12;1-5(2,3)4/h2-10H,11H2,1H3;(H2,1,2,3,4)