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

Systemtic Name: methyl 4-[[2-[(4-ethoxyphenyl)sulfonyl-(furan-2-ylmethyl)amino]ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-[(4-ethoxyphenyl)sulfonyl-(2-furylmethyl)amino]acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-[(4-ethoxyphenyl)sulfonyl-(2-furanylmethyl)amino]-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[(4-ethoxyphenyl)sulfonyl-(furan-2-ylmethyl)amino]acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[2-furfuryl(p-phenetylsulfonyl)amino]acetyl]amino]methyl]benzoic acid methyl ester Formula: C24H26N2O7S MolecularWeight: 486.53744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CO2)CC(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CO2)CC(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C24H26N2O7S/c1-3-32-20-10-12-22(13-11-20)34(29,30)26(16-21-5-4-14-33-21)17-23(27)25-15-18-6-8-19(9-7-18)24(28)31-2/h4-14H,3,15-17H2,1-2H3,(H,25,27)