3-[[4-acetamido-2-(3-naphthalen-1-ylbutan-2-yloxy)phenyl]sulfonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[[4-acetamido-2-(3-naphthalen-1-ylbutan-2-yloxy)phenyl]sulfonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[[4-acetamido-2-[1-methyl-2-(1-naphthyl)propoxy]phenyl]sulfonylamino]-4-oxo-butanoic acid CAS Name: 3-[[4-acetamido-2-[3-(1-naphthalenyl)butan-2-yloxy]phenyl]sulfonylamino]-4-oxobutanoic acid IUPAC Name: 3-[[4-acetamido-2-(3-naphthalen-1-ylbutan-2-yloxy)phenyl]sulfonylamino]-4-oxobutanoic acid Traditional Name: 3-[[4-acetamido-2-[1-methyl-2-(1-naphthyl)propoxy]phenyl]sulfonylamino]-4-keto-butyric acid Formula: C26H28N2O7S MolecularWeight: 512.57472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)C(C)OC3=C(C=CC(=C3)NC(=O)C)S(=O)(=O)NC(CC(=O)O)C=O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)C(C)OC3=C(C=CC(=C3)NC(=O)C)S(=O)(=O)NC(CC(=O)O)C=O

InChI

InChI=1S/C26H28N2O7S/c1-16(22-10-6-8-19-7-4-5-9-23(19)22)17(2)35-24-13-20(27-18(3)30)11-12-25(24)36(33,34)28-21(15-29)14-26(31)32/h4-13,15-17,21,28H,14H2,1-3H3,(H,27,30)(H,31,32)