2-[[4-[4-(3-hydroxyphenyl)piperazin-1-yl]phenyl]sulfonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[4-[4-(3-hydroxyphenyl)piperazin-1-yl]phenyl]sulfonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[4-[4-(3-hydroxyphenyl)piperazin-1-yl]phenyl]sulfonylamino]-3-phenyl-propanoic acid CAS Name: 2-[[4-[4-(3-hydroxyphenyl)-1-piperazinyl]phenyl]sulfonylamino]-3-phenylpropanoic acid IUPAC Name: 2-[[4-[4-(3-hydroxyphenyl)piperazin-1-yl]phenyl]sulfonylamino]-3-phenylpropanoic acid Traditional Name: 2-[[4-[4-(3-hydroxyphenyl)piperazino]phenyl]sulfonylamino]-3-phenyl-propionic acid Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)S(=O)(=O)NC(CC3=CC=CC=C3)C(=O)O)C4=CC(=CC=C4)O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)S(=O)(=O)NC(CC3=CC=CC=C3)C(=O)O)C4=CC(=CC=C4)O

InChI

InChI=1S/C25H27N3O5S/c29-22-8-4-7-21(18-22)28-15-13-27(14-16-28)20-9-11-23(12-10-20)34(32,33)26-24(25(30)31)17-19-5-2-1-3-6-19/h1-12,18,24,26,29H,13-17H2,(H,30,31)