3-(dimethylamino)-2-(1-phenylpropoxy)benzenesulfonamide phosphate

Systemtic Name: 3-(dimethylamino)-2-(1-phenylpropoxy)benzenesulfonamide phosphate Openeye Name: 3-(dimethylamino)-2-(1-phenylpropoxy)benzenesulfonamide phosphate CAS Name: 3-(dimethylamino)-2-(1-phenylpropoxy)benzenesulfonamide phosphate IUPAC Name: 3-(dimethylamino)-2-(1-phenylpropoxy)benzenesulfonamide phosphate Traditional Name: 3-(dimethylamino)-2-(1-phenylpropoxy)benzenesulfonamide phosphate Formula: C17H22N2O7PS-3 MolecularWeight: 429.404541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)OC2=C(C=CC=C2S(=O)(=O)N)N(C)C.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CCC(C1=CC=CC=C1)OC2=C(C=CC=C2S(=O)(=O)N)N(C)C.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C17H22N2O3S.H3O4P/c1-4-15(13-9-6-5-7-10-13)22-17-14(19(2)3)11-8-12-16(17)23(18,20)21;1-5(2,3)4/h5-12,15H,4H2,1-3H3,(H2,18,20,21);(H3,1,2,3,4)/p-3