3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-5-oxidanidyl-1H-pyrido[3,2-d]pyrimidin-5-ium-2,4-dione

Systemtic Name: 3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-5-oxidanidyl-1H-pyrido[3,2-d]pyrimidin-5-ium-2,4-dione Openeye Name: 3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-5-oxido-1H-pyrido[3,2-d]pyrimidin-5-ium-2,4-dione CAS Name: 3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-5-oxido-1H-pyrido[3,2-d]pyrimidin-5-ium-2,4-dione IUPAC Name: 3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-5-oxido-1H-pyrido[3,2-d]pyrimidin-5-ium-2,4-dione Traditional Name: 3-[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-5-oxido-1H-pyrido[3,2-d]pyrimidin-5-ium-2,4-quinone Formula: C22H18N4O5S MolecularWeight: 450.46712

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=CC(=C3)N4C(=O)C5=C(C=CC=[N+]5[O-])NC4=O

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=CC(=C3)N4C(=O)C5=C(C=CC=[N+]5[O-])NC4=O

InChI

InChI=1S/C22H18N4O5S/c27-21-20-18(10-5-12-24(20)29)23-22(28)26(21)16-8-3-9-17(14-16)32(30,31)25-13-4-7-15-6-1-2-11-19(15)25/h1-3,5-6,8-12,14H,4,7,13H2,(H,23,28)