2-azanyl-5-methyl-4-propan-2-yl-benzenesulfonic acid

Systemtic Name: 2-azanyl-5-methyl-4-propan-2-yl-benzenesulfonic acid Openeye Name: 2-amino-4-isopropyl-5-methyl-benzenesulfonic acid CAS Name: 2-amino-5-methyl-4-propan-2-ylbenzenesulfonic acid IUPAC Name: 2-amino-5-methyl-4-propan-2-ylbenzenesulfonic acid Traditional Name: 2-amino-4-isopropyl-5-methyl-besylic acid Formula: C10H15NO3S MolecularWeight: 229.296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(C)C)N)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1C(C)C)N)S(=O)(=O)O

InChI

InChI=1S/C10H15NO3S/c1-6(2)8-5-9(11)10(4-7(8)3)15(12,13)14/h4-6H,11H2,1-3H3,(H,12,13,14)