2-[2,4-bis(chloranyl)-6-methyl-phenyl]-10-(carboxymethyl)acridin-10-ium-9-carboxylic acid

Systemtic Name: 2-[2,4-bis(chloranyl)-6-methyl-phenyl]-10-(carboxymethyl)acridin-10-ium-9-carboxylic acid Openeye Name: 10-(carboxymethyl)-2-(2,4-dichloro-6-methyl-phenyl)acridin-10-ium-9-carboxylic acid CAS Name: 10-(carboxymethyl)-2-(2,4-dichloro-6-methylphenyl)-9-acridin-10-iumcarboxylic acid IUPAC Name: 10-(carboxymethyl)-2-(2,4-dichloro-6-methylphenyl)acridin-10-ium-9-carboxylic acid Traditional Name: 10-(carboxymethyl)-2-(2,4-dichloro-6-methyl-phenyl)acridin-10-ium-9-carboxylic acid Formula: C23H16Cl2NO4+ MolecularWeight: 441.28344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C2=CC3=C(C4=CC=CC=C4[N+](=C3C=C2)CC(=O)O)C(=O)O)Cl)Cl

Isomeric SMILES

CC1=CC(=CC(=C1C2=CC3=C(C4=CC=CC=C4[N+](=C3C=C2)CC(=O)O)C(=O)O)Cl)Cl

InChI

InChI=1S/C23H15Cl2NO4/c1-12-8-14(24)10-17(25)21(12)13-6-7-19-16(9-13)22(23(29)30)15-4-2-3-5-18(15)26(19)11-20(27)28/h2-10H,11H2,1H3,(H-,27,28,29,30)/p+1