(Z)-2-but-3-enoxy-3-[1-(phenylsulfonyl)indol-5-yl]prop-2-enoic acid

Systemtic Name: (Z)-2-but-3-enoxy-3-[1-(phenylsulfonyl)indol-5-yl]prop-2-enoic acid Openeye Name: (Z)-3-[1-(benzenesulfonyl)indol-5-yl]-2-but-3-enoxy-prop-2-enoic acid CAS Name: (Z)-3-[1-(benzenesulfonyl)-5-indolyl]-2-but-3-enoxy-2-propenoic acid IUPAC Name: (Z)-3-[1-(benzenesulfonyl)indol-5-yl]-2-but-3-enoxyprop-2-enoic acid Traditional Name: (Z)-3-(1-besylindol-5-yl)-2-but-3-enoxy-acrylic acid Formula: C21H19NO5S MolecularWeight: 397.44426

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCOC(=CC1=CC2=C(C=C1)N(C=C2)S(=O)(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C=CCCO/C(=C\C1=CC2=C(C=C1)N(C=C2)S(=O)(=O)C3=CC=CC=C3)/C(=O)O

InChI

InChI=1S/C21H19NO5S/c1-2-3-13-27-20(21(23)24)15-16-9-10-19-17(14-16)11-12-22(19)28(25,26)18-7-5-4-6-8-18/h2,4-12,14-15H,1,3,13H2,(H,23,24)/b20-15-