3-(6-azanyl-7-chloranyl-4H-quinolin-1-yl)-2,2-dimethyl-propane-1-sulfonic acid

Systemtic Name: 3-(6-azanyl-7-chloranyl-4H-quinolin-1-yl)-2,2-dimethyl-propane-1-sulfonic acid Openeye Name: 3-(6-amino-7-chloro-4H-quinolin-1-yl)-2,2-dimethyl-propane-1-sulfonic acid CAS Name: 3-(6-amino-7-chloro-4H-quinolin-1-yl)-2,2-dimethyl-1-propanesulfonic acid IUPAC Name: 3-(6-amino-7-chloro-4H-quinolin-1-yl)-2,2-dimethylpropane-1-sulfonic acid Traditional Name: 3-(6-amino-7-chloro-4H-quinolin-1-yl)-2,2-dimethyl-propane-1-sulfonic acid Formula: C14H19ClN2O3S MolecularWeight: 330.83026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1C=CCC2=CC(=C(C=C21)Cl)N)CS(=O)(=O)O

Isomeric SMILES

CC(C)(CN1C=CCC2=CC(=C(C=C21)Cl)N)CS(=O)(=O)O

InChI

InChI=1S/C14H19ClN2O3S/c1-14(2,9-21(18,19)20)8-17-5-3-4-10-6-12(16)11(15)7-13(10)17/h3,5-7H,4,8-9,16H2,1-2H3,(H,18,19,20)