5-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-[(4-phenoxyphenyl)sulfonylamino]pentanoic acid

Systemtic Name: 5-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-[(4-phenoxyphenyl)sulfonylamino]pentanoic acid Openeye Name: 5-(1,3-dioxoisoindolin-2-yl)-2-[(4-phenoxyphenyl)sulfonylamino]pentanoic acid CAS Name: 5-(1,3-dioxo-2-isoindolyl)-2-[(4-phenoxyphenyl)sulfonylamino]pentanoic acid IUPAC Name: 5-(1,3-dioxoisoindol-2-yl)-2-[(4-phenoxyphenyl)sulfonylamino]pentanoic acid Traditional Name: 2-[(4-phenoxyphenyl)sulfonylamino]-5-phthalimido-valeric acid Formula: C25H22N2O7S MolecularWeight: 494.51638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)S(=O)(=O)NC(CCCN3C(=O)C4=CC=CC=C4C3=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)S(=O)(=O)NC(CCCN3C(=O)C4=CC=CC=C4C3=O)C(=O)O

InChI

InChI=1S/C25H22N2O7S/c28-23-20-9-4-5-10-21(20)24(29)27(23)16-6-11-22(25(30)31)26-35(32,33)19-14-12-18(13-15-19)34-17-7-2-1-3-8-17/h1-5,7-10,12-15,22,26H,6,11,16H2,(H,30,31)