3-[[4-morpholin-4-yl-2-(2-naphthalen-1-ylethoxy)phenyl]sulfonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[[4-morpholin-4-yl-2-(2-naphthalen-1-ylethoxy)phenyl]sulfonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[[4-morpholino-2-[2-(1-naphthyl)ethoxy]phenyl]sulfonylamino]-4-oxo-butanoic acid CAS Name: 3-[[4-(4-morpholinyl)-2-[2-(1-naphthalenyl)ethoxy]phenyl]sulfonylamino]-4-oxobutanoic acid IUPAC Name: 3-[[4-morpholin-4-yl-2-(2-naphthalen-1-ylethoxy)phenyl]sulfonylamino]-4-oxobutanoic acid Traditional Name: 4-keto-3-[[4-morpholino-2-[2-(1-naphthyl)ethoxy]phenyl]sulfonylamino]butyric acid Formula: C26H28N2O7S MolecularWeight: 512.57472

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=C(C=C2)S(=O)(=O)NC(CC(=O)O)C=O)OCCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1COCCN1C2=CC(=C(C=C2)S(=O)(=O)NC(CC(=O)O)C=O)OCCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C26H28N2O7S/c29-18-21(16-26(30)31)27-36(32,33)25-9-8-22(28-11-14-34-15-12-28)17-24(25)35-13-10-20-6-3-5-19-4-1-2-7-23(19)20/h1-9,17-18,21,27H,10-16H2,(H,30,31)