1-[(4-aminophenyl)-ethyl-amino]butane-2-sulfonic acid

Systemtic Name: 1-[(4-aminophenyl)-ethyl-amino]butane-2-sulfonic acid Openeye Name: 1-(4-amino-N-ethyl-anilino)butane-2-sulfonic acid CAS Name: 1-(4-amino-N-ethylanilino)-2-butanesulfonic acid IUPAC Name: 1-(4-amino-N-ethylanilino)butane-2-sulfonic acid Traditional Name: 1-(4-amino-N-ethyl-anilino)butane-2-sulfonic acid Formula: C12H20N2O3S MolecularWeight: 272.3638

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN(CC)C1=CC=C(C=C1)N)S(=O)(=O)O

Isomeric SMILES

CCC(CN(CC)C1=CC=C(C=C1)N)S(=O)(=O)O

InChI

InChI=1S/C12H20N2O3S/c1-3-12(18(15,16)17)9-14(4-2)11-7-5-10(13)6-8-11/h5-8,12H,3-4,9,13H2,1-2H3,(H,15,16,17)