(3Z)-2-ethoxy-3-(phenylmethylidene)-5,6-bis(propan-2-ylsulfonyl)-1H-isoindole

Systemtic Name: (3Z)-2-ethoxy-3-(phenylmethylidene)-5,6-bis(propan-2-ylsulfonyl)-1H-isoindole Openeye Name: (1Z)-1-benzylidene-2-ethoxy-5,6-bis(isopropylsulfonyl)isoindoline CAS Name: (3Z)-2-ethoxy-3-(phenylmethylene)-5,6-bis(propan-2-ylsulfonyl)-1H-isoindole IUPAC Name: (3Z)-3-benzylidene-2-ethoxy-5,6-bis(propan-2-ylsulfonyl)-1H-isoindole Traditional Name: (1Z)-1-benzal-2-ethoxy-5,6-bis(isopropylsulfonyl)isoindoline Formula: C23H29NO5S2 MolecularWeight: 463.61006

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)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C23H29NO5S2/c1-6-29-24-15-19-13-22(30(25,26)16(2)3)23(31(27,28)17(4)5)14-20(19)21(24)12-18-10-8-7-9-11-18/h7-14,16-17H,6,15H2,1-5H3/b21-12-