(phenylmethyl) 2-[4-[acridin-9-ylcarbonyl-(4-methylphenyl)sulfonyl-amino]phenyl]ethanoate

Systemtic Name: (phenylmethyl) 2-[4-[acridin-9-ylcarbonyl-(4-methylphenyl)sulfonyl-amino]phenyl]ethanoate Openeye Name: benzyl 2-[4-[acridine-9-carbonyl(p-tolylsulfonyl)amino]phenyl]acetate CAS Name: 2-[4-[[9-acridinyl(oxo)methyl]-(4-methylphenyl)sulfonylamino]phenyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[4-[acridine-9-carbonyl-(4-methylphenyl)sulfonylamino]phenyl]acetate Traditional Name: 2-[4-[acridine-9-carbonyl(tosyl)amino]phenyl]acetic acid benzyl ester Formula: C36H28N2O5S MolecularWeight: 600.68292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC=C(C=C2)CC(=O)OCC3=CC=CC=C3)C(=O)C4=C5C=CC=CC5=NC6=CC=CC=C64

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC=C(C=C2)CC(=O)OCC3=CC=CC=C3)C(=O)C4=C5C=CC=CC5=NC6=CC=CC=C64

InChI

InChI=1S/C36H28N2O5S/c1-25-15-21-29(22-16-25)44(41,42)38(28-19-17-26(18-20-28)23-34(39)43-24-27-9-3-2-4-10-27)36(40)35-30-11-5-7-13-32(30)37-33-14-8-6-12-31(33)35/h2-22H,23-24H2,1H3