2-[1-[2-(4-methoxyphenyl)ethylamino]-1-oxidanylidene-propan-2-yl]oxy-5-morpholin-4-ylsulfonyl-benzoic acid

Systemtic Name: 2-[1-[2-(4-methoxyphenyl)ethylamino]-1-oxidanylidene-propan-2-yl]oxy-5-morpholin-4-ylsulfonyl-benzoic acid Openeye Name: 2-[2-[2-(4-methoxyphenyl)ethylamino]-1-methyl-2-oxo-ethoxy]-5-morpholinosulfonyl-benzoic acid CAS Name: 2-[1-[2-(4-methoxyphenyl)ethylamino]-1-oxopropan-2-yl]oxy-5-(4-morpholinylsulfonyl)benzoic acid IUPAC Name: 2-[1-[2-(4-methoxyphenyl)ethylamino]-1-oxopropan-2-yl]oxy-5-morpholin-4-ylsulfonylbenzoic acid Traditional Name: 2-[2-keto-2-[2-(4-methoxyphenyl)ethylamino]-1-methyl-ethoxy]-5-morpholinosulfonyl-benzoic acid Formula: C23H28N2O8S MolecularWeight: 492.54202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=C(C=C1)OC)OC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)O

Isomeric SMILES

CC(C(=O)NCCC1=CC=C(C=C1)OC)OC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)O

InChI

InChI=1S/C23H28N2O8S/c1-16(22(26)24-10-9-17-3-5-18(31-2)6-4-17)33-21-8-7-19(15-20(21)23(27)28)34(29,30)25-11-13-32-14-12-25/h3-8,15-16H,9-14H2,1-2H3,(H,24,26)(H,27,28)