2-azanyl-5-(3-butylpyrrolidin-1-yl)benzenesulfonic acid

Systemtic Name: 2-azanyl-5-(3-butylpyrrolidin-1-yl)benzenesulfonic acid Openeye Name: 2-amino-5-(3-butylpyrrolidin-1-yl)benzenesulfonic acid CAS Name: 2-amino-5-(3-butyl-1-pyrrolidinyl)benzenesulfonic acid IUPAC Name: 2-amino-5-(3-butylpyrrolidin-1-yl)benzenesulfonic acid Traditional Name: 2-amino-5-(3-butylpyrrolidino)besylic acid Formula: C14H22N2O3S MolecularWeight: 298.40108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCN(C1)C2=CC(=C(C=C2)N)S(=O)(=O)O

Isomeric SMILES

CCCCC1CCN(C1)C2=CC(=C(C=C2)N)S(=O)(=O)O

InChI

InChI=1S/C14H22N2O3S/c1-2-3-4-11-7-8-16(10-11)12-5-6-13(15)14(9-12)20(17,18)19/h5-6,9,11H,2-4,7-8,10,15H2,1H3,(H,17,18,19)