cyclopentanone; N-(4-methylphenyl)sulfonyl-N-[1-oxidanyl-2,5-bis(oxidanylidene)pyrrolidin-1-ium-1-yl]acridine-9-carboxamide

Systemtic Name: cyclopentanone; N-(4-methylphenyl)sulfonyl-N-[1-oxidanyl-2,5-bis(oxidanylidene)pyrrolidin-1-ium-1-yl]acridine-9-carboxamide Openeye Name: cyclopentanone; N-(1-hydroxy-2,5-dioxo-pyrrolidin-1-ium-1-yl)-N-(p-tolylsulfonyl)acridine-9-carboxamide CAS Name: cyclopentanone; N-(1-hydroxy-2,5-dioxo-1-pyrrolidin-1-iumyl)-N-(4-methylphenyl)sulfonyl-9-acridinecarboxamide IUPAC Name: cyclopentanone; N-(1-hydroxy-2,5-dioxopyrrolidin-1-ium-1-yl)-N-(4-methylphenyl)sulfonylacridine-9-carboxamide Traditional Name: cyclopentanone; N-(1-hydroxy-2,5-diketo-pyrrolidin-1-ium-1-yl)-N-tosyl-acridine-9-carboxamide Formula: C30H28N3O7S+ MolecularWeight: 574.62422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C(=O)C2=C3C=CC=CC3=NC4=CC=CC=C42)[N+]5(C(=O)CCC5=O)O.C1CCC(=O)C1

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C(=O)C2=C3C=CC=CC3=NC4=CC=CC=C42)[N+]5(C(=O)CCC5=O)O.C1CCC(=O)C1

InChI

InChI=1S/C25H20N3O6S.C5H8O/c1-16-10-12-17(13-11-16)35(33,34)27(28(32)22(29)14-15-23(28)30)25(31)24-18-6-2-4-8-20(18)26-21-9-5-3-7-19(21)24;6-5-3-1-2-4-5/h2-13,32H,14-15H2,1H3;1-4H2/q+1;