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

Systemtic Name: 3-[1-[(4-methoxyphenyl)sulfonylamino]indol-2-yl]propanoic acid Openeye Name: 3-[1-[(4-methoxyphenyl)sulfonylamino]indol-2-yl]propanoic acid CAS Name: 3-[1-[(4-methoxyphenyl)sulfonylamino]-2-indolyl]propanoic acid IUPAC Name: 3-[1-[(4-methoxyphenyl)sulfonylamino]indol-2-yl]propanoic acid Traditional Name: 3-[1-[(4-methoxyphenyl)sulfonylamino]indol-2-yl]propionic acid Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NN2C3=CC=CC=C3C=C2CCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NN2C3=CC=CC=C3C=C2CCC(=O)O

InChI

InChI=1S/C18H18N2O5S/c1-25-15-7-9-16(10-8-15)26(23,24)19-20-14(6-11-18(21)22)12-13-4-2-3-5-17(13)20/h2-5,7-10,12,19H,6,11H2,1H3,(H,21,22)