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

Systemtic Name: methyl 4-[[2-[(4-chlorophenyl)sulfonyl-methyl-amino]ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-[(4-chlorophenyl)sulfonyl-methyl-amino]acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-[(4-chlorophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[(4-chlorophenyl)sulfonyl-methylamino]acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[(4-chlorophenyl)sulfonyl-methyl-amino]acetyl]amino]methyl]benzoic acid methyl ester Formula: C18H19ClN2O5S MolecularWeight: 410.87186

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NCC1=CC=C(C=C1)C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CN(CC(=O)NCC1=CC=C(C=C1)C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H19ClN2O5S/c1-21(27(24,25)16-9-7-15(19)8-10-16)12-17(22)20-11-13-3-5-14(6-4-13)18(23)26-2/h3-10H,11-12H2,1-2H3,(H,20,22)