2-azaniumylethylsulfonyl-[4-(2-methylphenoxy)phenyl]azanide

Systemtic Name: 2-azaniumylethylsulfonyl-[4-(2-methylphenoxy)phenyl]azanide Openeye Name: 2-azaniumylethylsulfonyl-[4-(2-methylphenoxy)phenyl]azanide CAS Name: 2-ammonioethylsulfonyl-[4-(2-methylphenoxy)phenyl]azanide IUPAC Name: 2-azaniumylethylsulfonyl-[4-(2-methylphenoxy)phenyl]azanide Traditional Name: 2-ammonioethylsulfonyl-[4-(2-methylphenoxy)phenyl]azanide Formula: C15H18N2O3S MolecularWeight: 306.38002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC=C(C=C2)[N-]S(=O)(=O)CC[NH3+]

Isomeric SMILES

CC1=CC=CC=C1OC2=CC=C(C=C2)[N-]S(=O)(=O)CC[NH3+]

InChI

InChI=1S/C15H17N2O3S/c1-12-4-2-3-5-15(12)20-14-8-6-13(7-9-14)17-21(18,19)11-10-16/h2-9H,10-11,16H2,1H3/q-1/p+1