4-azanylbenzenecarboximidamide; 2-methylbenzenesulfonic acid

Systemtic Name: 4-azanylbenzenecarboximidamide; 2-methylbenzenesulfonic acid Openeye Name: 4-aminobenzamidine; 2-methylbenzenesulfonic acid CAS Name: 4-aminobenzenecarboximidamide; 2-methylbenzenesulfonic acid IUPAC Name: 4-aminobenzenecarboximidamide; 2-methylbenzenesulfonic acid Traditional Name: 4-aminobenzamidine; 2-methylbesylic acid Formula: C21H25N3O6S2 MolecularWeight: 479.5697

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)O.CC1=CC=CC=C1S(=O)(=O)O.C1=CC(=CC=C1C(=N)N)N

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)O.CC1=CC=CC=C1S(=O)(=O)O.C1=CC(=CC=C1C(=N)N)N

InChI

InChI=1S/C7H9N3.2C7H8O3S/c8-6-3-1-5(2-4-6)7(9)10;2*1-6-4-2-3-5-7(6)11(8,9)10/h1-4H,8H2,(H3,9,10);2*2-5H,1H3,(H,8,9,10)