methyl 6-[2-[(4-chlorophenyl)sulfonyl-(phenylmethyl)amino]ethanoylamino]hexanoate

Systemtic Name: methyl 6-[2-[(4-chlorophenyl)sulfonyl-(phenylmethyl)amino]ethanoylamino]hexanoate Openeye Name: methyl 6-[[2-[benzyl-(4-chlorophenyl)sulfonyl-amino]acetyl]amino]hexanoate CAS Name: 6-[[2-[(4-chlorophenyl)sulfonyl-(phenylmethyl)amino]-1-oxoethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[2-[benzyl-(4-chlorophenyl)sulfonylamino]acetyl]amino]hexanoate Traditional Name: 6-[[2-[benzyl-(4-chlorophenyl)sulfonyl-amino]acetyl]amino]hexanoic acid methyl ester Formula: C22H27ClN2O5S MolecularWeight: 466.97818

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)CCCCCNC(=O)CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H27ClN2O5S/c1-30-22(27)10-6-3-7-15-24-21(26)17-25(16-18-8-4-2-5-9-18)31(28,29)20-13-11-19(23)12-14-20/h2,4-5,8-9,11-14H,3,6-7,10,15-17H2,1H3,(H,24,26)