6-methoxy-N-methyl-4,5-dihydrobenzo[g][1,3]benzoxazol-2-amine; 4-methylbenzenesulfonic acid

Systemtic Name: 6-methoxy-N-methyl-4,5-dihydrobenzo[g][1,3]benzoxazol-2-amine; 4-methylbenzenesulfonic acid Openeye Name: 6-methoxy-N-methyl-4,5-dihydrobenzo[g][1,3]benzoxazol-2-amine; 4-methylbenzenesulfonic acid CAS Name: 6-methoxy-N-methyl-4,5-dihydrobenzo[g][1,3]benzoxazol-2-amine; 4-methylbenzenesulfonic acid IUPAC Name: 6-methoxy-N-methyl-4,5-dihydrobenzo[g][1,3]benzoxazol-2-amine; 4-methylbenzenesulfonic acid Traditional Name: (6-methoxy-4,5-dihydrobenzo[g][1,3]benzoxazol-2-yl)-methyl-amine; tosylic acid Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CNC1=NC2=C(O1)C3=C(CC2)C(=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CNC1=NC2=C(O1)C3=C(CC2)C(=CC=C3)OC

InChI

InChI=1S/C13H14N2O2.C7H8O3S/c1-14-13-15-10-7-6-8-9(12(10)17-13)4-3-5-11(8)16-2;1-6-2-4-7(5-3-6)11(8,9)10/h3-5H,6-7H2,1-2H3,(H,14,15);2-5H,1H3,(H,8,9,10)