3-[3-[2-[(4-phenoxyphenyl)sulfonylamino]ethyl]indol-1-yl]propanoic acid

Systemtic Name: 3-[3-[2-[(4-phenoxyphenyl)sulfonylamino]ethyl]indol-1-yl]propanoic acid Openeye Name: 3-[3-[2-[(4-phenoxyphenyl)sulfonylamino]ethyl]indol-1-yl]propanoic acid CAS Name: 3-[3-[2-[(4-phenoxyphenyl)sulfonylamino]ethyl]-1-indolyl]propanoic acid IUPAC Name: 3-[3-[2-[(4-phenoxyphenyl)sulfonylamino]ethyl]indol-1-yl]propanoic acid Traditional Name: 3-[3-[2-[(4-phenoxyphenyl)sulfonylamino]ethyl]indol-1-yl]propionic acid Formula: C25H24N2O5S MolecularWeight: 464.53346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)S(=O)(=O)NCCC3=CN(C4=CC=CC=C43)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)S(=O)(=O)NCCC3=CN(C4=CC=CC=C43)CCC(=O)O

InChI

InChI=1S/C25H24N2O5S/c28-25(29)15-17-27-18-19(23-8-4-5-9-24(23)27)14-16-26-33(30,31)22-12-10-21(11-13-22)32-20-6-2-1-3-7-20/h1-13,18,26H,14-17H2,(H,28,29)