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

Systemtic Name: 2-[1-[(2-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl]oxy-5-morpholin-4-ylsulfonyl-benzoic acid Openeye Name: 2-[2-[(2-methoxyphenyl)methylamino]-1-methyl-2-oxo-ethoxy]-5-morpholinosulfonyl-benzoic acid CAS Name: 2-[1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl]oxy-5-(4-morpholinylsulfonyl)benzoic acid IUPAC Name: 2-[1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl]oxy-5-morpholin-4-ylsulfonylbenzoic acid Traditional Name: 2-[2-keto-1-methyl-2-(o-anisylamino)ethoxy]-5-morpholinosulfonyl-benzoic acid Formula: C22H26N2O8S MolecularWeight: 478.51544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1OC)OC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)O

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1OC)OC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)O

InChI

InChI=1S/C22H26N2O8S/c1-15(21(25)23-14-16-5-3-4-6-19(16)30-2)32-20-8-7-17(13-18(20)22(26)27)33(28,29)24-9-11-31-12-10-24/h3-8,13,15H,9-12,14H2,1-2H3,(H,23,25)(H,26,27)