(3E)-2-ethoxy-5-methoxy-3-(phenylmethylidene)-6-propan-2-ylsulfonyl-1H-isoindole

Systemtic Name: (3E)-2-ethoxy-5-methoxy-3-(phenylmethylidene)-6-propan-2-ylsulfonyl-1H-isoindole Openeye Name: (1E)-1-benzylidene-2-ethoxy-5-isopropylsulfonyl-6-methoxy-isoindoline CAS Name: (3E)-2-ethoxy-5-methoxy-3-(phenylmethylene)-6-propan-2-ylsulfonyl-1H-isoindole IUPAC Name: (3E)-3-benzylidene-2-ethoxy-5-methoxy-6-propan-2-ylsulfonyl-1H-isoindole Traditional Name: (1E)-1-benzal-2-ethoxy-5-isopropylsulfonyl-6-methoxy-isoindoline Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CCON1CC2=CC(=C(C=C2C1=CC3=CC=CC=C3)OC)S(=O)(=O)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO4S/c1-5-26-22-14-17-12-21(27(23,24)15(2)3)20(25-4)13-18(17)19(22)11-16-9-7-6-8-10-16/h6-13,15H,5,14H2,1-4H3/b19-11+