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

Systemtic Name: 4-[[4-[(4-aminophenyl)methyl]phenyl]amino]butane-1-sulfonic acid Openeye Name: 4-[4-[(4-aminophenyl)methyl]anilino]butane-1-sulfonic acid CAS Name: 4-[4-[(4-aminophenyl)methyl]anilino]-1-butanesulfonic acid IUPAC Name: 4-[4-[(4-aminophenyl)methyl]anilino]butane-1-sulfonic acid Traditional Name: 4-[4-(4-aminobenzyl)anilino]butane-1-sulfonic acid Formula: C17H22N2O3S MolecularWeight: 334.43318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CC=C(C=C2)NCCCCS(=O)(=O)O)N

Isomeric SMILES

C1=CC(=CC=C1CC2=CC=C(C=C2)NCCCCS(=O)(=O)O)N

InChI

InChI=1S/C17H22N2O3S/c18-16-7-3-14(4-8-16)13-15-5-9-17(10-6-15)19-11-1-2-12-23(20,21)22/h3-10,19H,1-2,11-13,18H2,(H,20,21,22)