4-azanylbenzenesulfonic acid; benzene-1,3-diol; 2,4-dimethylaniline

Systemtic Name: 4-azanylbenzenesulfonic acid; benzene-1,3-diol; 2,4-dimethylaniline Openeye Name: 4-aminobenzenesulfonic acid; benzene-1,3-diol; 2,4-dimethylaniline CAS Name: 4-aminobenzenesulfonic acid; benzene-1,3-diol; 2,4-dimethylaniline IUPAC Name: 4-aminobenzenesulfonic acid; benzene-1,3-diol; 2,4-dimethylaniline Traditional Name: 4-aminobesylic acid; resorcinol; 2,4-xylidine Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N)C.C1=CC(=CC(=C1)O)O.C1=CC(=CC=C1N)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)N)C.C1=CC(=CC(=C1)O)O.C1=CC(=CC=C1N)S(=O)(=O)O

InChI

InChI=1S/C8H11N.C6H7NO3S.C6H6O2/c1-6-3-4-8(9)7(2)5-6;7-5-1-3-6(4-2-5)11(8,9)10;7-5-2-1-3-6(8)4-5/h3-5H,9H2,1-2H3;1-4H,7H2,(H,8,9,10);1-4,7-8H