4-(propan-2-ylamino)benzenesulfonic acid

Systemtic Name: 4-(propan-2-ylamino)benzenesulfonic acid Openeye Name: 4-(isopropylamino)benzenesulfonic acid CAS Name: 4-(propan-2-ylamino)benzenesulfonic acid IUPAC Name: 4-(propan-2-ylamino)benzenesulfonic acid Traditional Name: 4-(isopropylamino)besylic acid Formula: C9H13NO3S MolecularWeight: 215.26942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CC(C)NC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C9H13NO3S/c1-7(2)10-8-3-5-9(6-4-8)14(11,12)13/h3-7,10H,1-2H3,(H,11,12,13)