2-[3-[4-[[[3-[bis(methylsulfonyl)amino]-2-methyl-phenyl]-(phenylmethyl)amino]methyl]phenyl]carbonylphenoxy]ethanoate

Systemtic Name: 2-[3-[4-[[[3-[bis(methylsulfonyl)amino]-2-methyl-phenyl]-(phenylmethyl)amino]methyl]phenyl]carbonylphenoxy]ethanoate Openeye Name: 2-[3-[4-[[N-benzyl-3-[bis(methylsulfonyl)amino]-2-methyl-anilino]methyl]benzoyl]phenoxy]acetate CAS Name: 2-[3-[[4-[[3-[bis(methylsulfonyl)amino]-2-methyl-N-(phenylmethyl)anilino]methyl]phenyl]-oxomethyl]phenoxy]acetate IUPAC Name: 2-[3-[4-[[N-benzyl-3-[bis(methylsulfonyl)amino]-2-methylanilino]methyl]benzoyl]phenoxy]acetate Traditional Name: 2-[3-[4-[[N-benzyl-3-(dimesylamino)-2-methyl-anilino]methyl]benzoyl]phenoxy]acetate Formula: C32H31N2O8S2- MolecularWeight: 635.72714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1N(S(=O)(=O)C)S(=O)(=O)C)N(CC2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)C4=CC(=CC=C4)OCC(=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1N(S(=O)(=O)C)S(=O)(=O)C)N(CC2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)C4=CC(=CC=C4)OCC(=O)[O-]

InChI

InChI=1S/C32H32N2O8S2/c1-23-29(13-8-14-30(23)34(43(2,38)39)44(3,40)41)33(20-24-9-5-4-6-10-24)21-25-15-17-26(18-16-25)32(37)27-11-7-12-28(19-27)42-22-31(35)36/h4-19H,20-22H2,1-3H3,(H,35,36)/p-1