methyl 3-[2-[(4-ethoxyphenyl)sulfonyl-phenyl-amino]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[(4-ethoxyphenyl)sulfonyl-phenyl-amino]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-(N-(4-ethoxyphenyl)sulfonylanilino)acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-(N-(4-ethoxyphenyl)sulfonylanilino)-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-(N-(4-ethoxyphenyl)sulfonylanilino)acetyl]amino]-4-methylbenzoate Traditional Name: 4-methyl-3-[[2-(N-p-phenetylsulfonylanilino)acetyl]amino]benzoic acid methyl ester Formula: C25H26N2O6S MolecularWeight: 482.54874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=C(C=CC(=C2)C(=O)OC)C)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=C(C=CC(=C2)C(=O)OC)C)C3=CC=CC=C3

InChI

InChI=1S/C25H26N2O6S/c1-4-33-21-12-14-22(15-13-21)34(30,31)27(20-8-6-5-7-9-20)17-24(28)26-23-16-19(25(29)32-3)11-10-18(23)2/h5-16H,4,17H2,1-3H3,(H,26,28)