6-[4-(7-chloranylquinolin-1-ium-4-yl)piperazin-1-yl]sulfonyl-1,4-dimethyl-quinoxaline-2,3-dione

Systemtic Name: 6-[4-(7-chloranylquinolin-1-ium-4-yl)piperazin-1-yl]sulfonyl-1,4-dimethyl-quinoxaline-2,3-dione Openeye Name: 6-[4-(7-chloroquinolin-1-ium-4-yl)piperazin-1-yl]sulfonyl-1,4-dimethyl-quinoxaline-2,3-dione CAS Name: 6-[[4-(7-chloro-4-quinolin-1-iumyl)-1-piperazinyl]sulfonyl]-1,4-dimethylquinoxaline-2,3-dione IUPAC Name: 6-[4-(7-chloroquinolin-1-ium-4-yl)piperazin-1-yl]sulfonyl-1,4-dimethylquinoxaline-2,3-dione Traditional Name: 6-[4-(7-chloroquinolin-1-ium-4-yl)piperazino]sulfonyl-1,4-dimethyl-quinoxaline-2,3-quinone Formula: C23H23ClN5O4S+ MolecularWeight: 500.97782

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=C5C=CC(=CC5=[NH+]C=C4)Cl)N(C(=O)C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=C5C=CC(=CC5=[NH+]C=C4)Cl)N(C(=O)C1=O)C

InChI

InChI=1S/C23H22ClN5O4S/c1-26-20-6-4-16(14-21(20)27(2)23(31)22(26)30)34(32,33)29-11-9-28(10-12-29)19-7-8-25-18-13-15(24)3-5-17(18)19/h3-8,13-14H,9-12H2,1-2H3/p+1