2-[(4-methoxy-3-methyl-phenyl)sulfonyl-propan-2-yl-amino]ethylazanium

Systemtic Name: 2-[(4-methoxy-3-methyl-phenyl)sulfonyl-propan-2-yl-amino]ethylazanium Openeye Name: 2-[isopropyl-(4-methoxy-3-methyl-phenyl)sulfonyl-amino]ethylammonium CAS Name: 2-[(4-methoxy-3-methylphenyl)sulfonyl-propan-2-ylamino]ethylammonium IUPAC Name: 2-[(4-methoxy-3-methylphenyl)sulfonyl-propan-2-ylamino]ethylazanium Traditional Name: 2-[isopropyl-(4-methoxy-3-methyl-phenyl)sulfonyl-amino]ethylammonium Formula: C13H23N2O3S+ MolecularWeight: 287.39832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N(CC[NH3+])C(C)C)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N(CC[NH3+])C(C)C)OC

InChI

InChI=1S/C13H22N2O3S/c1-10(2)15(8-7-14)19(16,17)12-5-6-13(18-4)11(3)9-12/h5-6,9-10H,7-8,14H2,1-4H3/p+1