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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCS(=O)(=O)O)C1=CC=C(C=C1)N

Isomeric SMILES

CCN(CCCCS(=O)(=O)O)C1=CC=C(C=C1)N

InChI

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