2-[[4-(dimethylsulfamoylamino)phenyl]methylamino]-7-methoxy-quinoline-3-carboxylic acid

Systemtic Name: 2-[[4-(dimethylsulfamoylamino)phenyl]methylamino]-7-methoxy-quinoline-3-carboxylic acid Openeye Name: 2-[[4-(dimethylsulfamoylamino)phenyl]methylamino]-7-methoxy-quinoline-3-carboxylic acid CAS Name: 2-[[4-(dimethylsulfamoylamino)phenyl]methylamino]-7-methoxy-3-quinolinecarboxylic acid IUPAC Name: 2-[[4-(dimethylsulfamoylamino)phenyl]methylamino]-7-methoxyquinoline-3-carboxylic acid Traditional Name: 2-[[4-(dimethylsulfamoylamino)benzyl]amino]-7-methoxy-quinoline-3-carboxylic acid Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)NC1=CC=C(C=C1)CNC2=C(C=C3C=CC(=CC3=N2)OC)C(=O)O

Isomeric SMILES

CN(C)S(=O)(=O)NC1=CC=C(C=C1)CNC2=C(C=C3C=CC(=CC3=N2)OC)C(=O)O

InChI

InChI=1S/C20H22N4O5S/c1-24(2)30(27,28)23-15-7-4-13(5-8-15)12-21-19-17(20(25)26)10-14-6-9-16(29-3)11-18(14)22-19/h4-11,23H,12H2,1-3H3,(H,21,22)(H,25,26)