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

Systemtic Name: 4-[(4-aminophenyl)-butyl-amino]butane-1-sulfonic acid Openeye Name: 4-(4-amino-N-butyl-anilino)butane-1-sulfonic acid CAS Name: 4-(4-amino-N-butylanilino)-1-butanesulfonic acid IUPAC Name: 4-(4-amino-N-butylanilino)butane-1-sulfonic acid Traditional Name: 4-(4-amino-N-butyl-anilino)butane-1-sulfonic acid Formula: C14H24N2O3S MolecularWeight: 300.41696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H24N2O3S/c1-2-3-10-16(11-4-5-12-20(17,18)19)14-8-6-13(15)7-9-14/h6-9H,2-5,10-12,15H2,1H3,(H,17,18,19)