2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-(phenylmethyl)amino]ethanoate

Systemtic Name: 2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-(phenylmethyl)amino]ethanoate Openeye Name: 2-[benzyl-(4-ethoxy-3-methyl-phenyl)sulfonyl-amino]acetate CAS Name: 2-[(4-ethoxy-3-methylphenyl)sulfonyl-(phenylmethyl)amino]acetate IUPAC Name: 2-[benzyl-(4-ethoxy-3-methylphenyl)sulfonylamino]acetate Traditional Name: 2-[benzyl-(4-ethoxy-3-methyl-phenyl)sulfonyl-amino]acetate Formula: C18H20NO5S- MolecularWeight: 362.4201

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)[O-])C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)[O-])C

InChI

InChI=1S/C18H21NO5S/c1-3-24-17-10-9-16(11-14(17)2)25(22,23)19(13-18(20)21)12-15-7-5-4-6-8-15/h4-11H,3,12-13H2,1-2H3,(H,20,21)/p-1