2-[(10-methylacridin-10-ium-9-yl)carbonyl-(4-methylphenyl)sulfonyl-amino]ethanoic acid

Systemtic Name: 2-[(10-methylacridin-10-ium-9-yl)carbonyl-(4-methylphenyl)sulfonyl-amino]ethanoic acid Openeye Name: 2-[(10-methylacridin-10-ium-9-carbonyl)-(p-tolylsulfonyl)amino]acetic acid CAS Name: 2-[[(10-methyl-9-acridin-10-iumyl)-oxomethyl]-(4-methylphenyl)sulfonylamino]acetic acid IUPAC Name: 2-[(10-methylacridin-10-ium-9-carbonyl)-(4-methylphenyl)sulfonylamino]acetic acid Traditional Name: 2-[(10-methylacridin-10-ium-9-carbonyl)-tosyl-amino]acetic acid Formula: C24H21N2O5S+ MolecularWeight: 449.49894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)O)C(=O)C2=C3C=CC=CC3=[N+](C4=CC=CC=C42)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)O)C(=O)C2=C3C=CC=CC3=[N+](C4=CC=CC=C42)C

InChI

InChI=1S/C24H20N2O5S/c1-16-11-13-17(14-12-16)32(30,31)26(15-22(27)28)24(29)23-18-7-3-5-9-20(18)25(2)21-10-6-4-8-19(21)23/h3-14H,15H2,1-2H3/p+1