phenyl (1Z)-2-ethoxy-1-(phenylmethylidene)-6-propan-2-ylsulfonyl-3H-isoindole-5-sulfonate

Systemtic Name: phenyl (1Z)-2-ethoxy-1-(phenylmethylidene)-6-propan-2-ylsulfonyl-3H-isoindole-5-sulfonate Openeye Name: phenyl (1Z)-1-benzylidene-2-ethoxy-6-isopropylsulfonyl-isoindoline-5-sulfonate CAS Name: (1Z)-2-ethoxy-1-(phenylmethylene)-6-propan-2-ylsulfonyl-3H-isoindole-5-sulfonic acid phenyl ester IUPAC Name: phenyl (1Z)-1-benzylidene-2-ethoxy-6-propan-2-ylsulfonyl-3H-isoindole-5-sulfonate Traditional Name: (1Z)-1-benzal-2-ethoxy-6-isopropylsulfonyl-isoindoline-5-sulfonic acid phenyl ester Formula: C26H27NO6S2 MolecularWeight: 513.62568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCON1CC2=CC(=C(C=C2C1=CC3=CC=CC=C3)S(=O)(=O)C(C)C)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CCON\1CC2=CC(=C(C=C2/C1=C/C3=CC=CC=C3)S(=O)(=O)C(C)C)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C26H27NO6S2/c1-4-32-27-18-21-16-26(35(30,31)33-22-13-9-6-10-14-22)25(34(28,29)19(2)3)17-23(21)24(27)15-20-11-7-5-8-12-20/h5-17,19H,4,18H2,1-3H3/b24-15-