3-chloranyl-4-[(7,8-dimethoxyimidazo[1,5-a]quinoxalin-4-yl)amino]-5-methyl-benzenesulfonic acid

Systemtic Name: 3-chloranyl-4-[(7,8-dimethoxyimidazo[1,5-a]quinoxalin-4-yl)amino]-5-methyl-benzenesulfonic acid Openeye Name: 3-chloro-4-[(7,8-dimethoxyimidazo[1,5-a]quinoxalin-4-yl)amino]-5-methyl-benzenesulfonic acid CAS Name: 3-chloro-4-[(7,8-dimethoxy-4-imidazo[1,5-a]quinoxalinyl)amino]-5-methylbenzenesulfonic acid IUPAC Name: 3-chloro-4-[(7,8-dimethoxyimidazo[1,5-a]quinoxalin-4-yl)amino]-5-methylbenzenesulfonic acid Traditional Name: 3-chloro-4-[(7,8-dimethoxyimidazo[1,5-a]quinoxalin-4-yl)amino]-5-methyl-besylic acid Formula: C19H17ClN4O5S MolecularWeight: 448.88008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC2=NC3=CC(=C(C=C3N4C2=CN=C4)OC)OC)Cl)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1NC2=NC3=CC(=C(C=C3N4C2=CN=C4)OC)OC)Cl)S(=O)(=O)O

InChI

InChI=1S/C19H17ClN4O5S/c1-10-4-11(30(25,26)27)5-12(20)18(10)23-19-15-8-21-9-24(15)14-7-17(29-3)16(28-2)6-13(14)22-19/h4-9H,1-3H3,(H,22,23)(H,25,26,27)