4-(aminomethyl)-2-azanyl-5-ethyl-benzenesulfonic acid

Systemtic Name: 4-(aminomethyl)-2-azanyl-5-ethyl-benzenesulfonic acid Openeye Name: 2-amino-4-(aminomethyl)-5-ethyl-benzenesulfonic acid CAS Name: 2-amino-4-(aminomethyl)-5-ethylbenzenesulfonic acid IUPAC Name: 2-amino-4-(aminomethyl)-5-ethylbenzenesulfonic acid Traditional Name: 2-amino-4-(aminomethyl)-5-ethyl-besylic acid Formula: C9H14N2O3S MolecularWeight: 230.28406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1CN)N)S(=O)(=O)O

Isomeric SMILES

CCC1=CC(=C(C=C1CN)N)S(=O)(=O)O

InChI

InChI=1S/C9H14N2O3S/c1-2-6-4-9(15(12,13)14)8(11)3-7(6)5-10/h3-4H,2,5,10-11H2,1H3,(H,12,13,14)