2-[4-[2,5-bis(oxidanylidene)pyrrolidin-3-yl]oxy-4-oxidanylidene-butoxy]-10-methyl-1-phenyl-acridin-10-ium-9-carboxylic acid

Systemtic Name: 2-[4-[2,5-bis(oxidanylidene)pyrrolidin-3-yl]oxy-4-oxidanylidene-butoxy]-10-methyl-1-phenyl-acridin-10-ium-9-carboxylic acid Openeye Name: 2-[4-(2,5-dioxopyrrolidin-3-yl)oxy-4-oxo-butoxy]-10-methyl-1-phenyl-acridin-10-ium-9-carboxylic acid CAS Name: 2-[4-[(2,5-dioxo-3-pyrrolidinyl)oxy]-4-oxobutoxy]-10-methyl-1-phenyl-9-acridin-10-iumcarboxylic acid IUPAC Name: 2-[4-(2,5-dioxopyrrolidin-3-yl)oxy-4-oxobutoxy]-10-methyl-1-phenylacridin-10-ium-9-carboxylic acid Traditional Name: 2-[4-(2,5-diketopyrrolidin-3-yl)oxy-4-keto-butoxy]-10-methyl-1-phenyl-acridin-10-ium-9-carboxylic acid Formula: C29H25N2O7+ MolecularWeight: 513.518

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=CC(=C(C2=C(C3=CC=CC=C31)C(=O)O)C4=CC=CC=C4)OCCCC(=O)OC5CC(=O)NC5=O

Isomeric SMILES

C[N+]1=C2C=CC(=C(C2=C(C3=CC=CC=C31)C(=O)O)C4=CC=CC=C4)OCCCC(=O)OC5CC(=O)NC5=O

InChI

InChI=1S/C29H24N2O7/c1-31-19-11-6-5-10-18(19)26(29(35)36)27-20(31)13-14-21(25(27)17-8-3-2-4-9-17)37-15-7-12-24(33)38-22-16-23(32)30-28(22)34/h2-6,8-11,13-14,22H,7,12,15-16H2,1H3,(H-,30,32,34,35,36)/p+1