2-[(E)-3-[5-chloranyl-1-(phenylsulfonyl)indol-3-yl]-3-oxidanyl-prop-2-enoyl]benzoic acid

Systemtic Name: 2-[(E)-3-[5-chloranyl-1-(phenylsulfonyl)indol-3-yl]-3-oxidanyl-prop-2-enoyl]benzoic acid Openeye Name: 2-[(E)-3-[1-(benzenesulfonyl)-5-chloro-indol-3-yl]-3-hydroxy-prop-2-enoyl]benzoic acid CAS Name: 2-[(E)-3-[1-(benzenesulfonyl)-5-chloro-3-indolyl]-3-hydroxy-1-oxoprop-2-enyl]benzoic acid IUPAC Name: 2-[(E)-3-[1-(benzenesulfonyl)-5-chloroindol-3-yl]-3-hydroxyprop-2-enoyl]benzoic acid Traditional Name: 2-[(E)-3-(1-besyl-5-chloro-indol-3-yl)-3-hydroxy-acryloyl]benzoic acid Formula: C24H16ClNO6S MolecularWeight: 481.90494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Cl)C(=CC(=O)C4=CC=CC=C4C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Cl)/C(=C\C(=O)C4=CC=CC=C4C(=O)O)/O

InChI

InChI=1S/C24H16ClNO6S/c25-15-10-11-21-19(12-15)20(14-26(21)33(31,32)16-6-2-1-3-7-16)23(28)13-22(27)17-8-4-5-9-18(17)24(29)30/h1-14,28H,(H,29,30)/b23-13+