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

Systemtic Name: methyl 4-[[2-[4-[(4-ethoxyphenyl)sulfonyl-methyl-amino]phenoxy]ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-[4-[(4-ethoxyphenyl)sulfonyl-methyl-amino]phenoxy]acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-[4-[(4-ethoxyphenyl)sulfonyl-methylamino]phenoxy]-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[4-[(4-ethoxyphenyl)sulfonyl-methylamino]phenoxy]acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[4-[methyl(p-phenetylsulfonyl)amino]phenoxy]acetyl]amino]methyl]benzoic acid methyl ester Formula: C26H28N2O7S MolecularWeight: 512.57472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C26H28N2O7S/c1-4-34-22-13-15-24(16-14-22)36(31,32)28(2)21-9-11-23(12-10-21)35-18-25(29)27-17-19-5-7-20(8-6-19)26(30)33-3/h5-16H,4,17-18H2,1-3H3,(H,27,29)