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

Systemtic Name: (3E)-6-chloranyl-2-ethoxy-3-(phenylmethylidene)-5-propan-2-ylsulfonyl-1H-isoindole Openeye Name: (1E)-1-benzylidene-5-chloro-2-ethoxy-6-isopropylsulfonyl-isoindoline CAS Name: (3E)-6-chloro-2-ethoxy-3-(phenylmethylene)-5-propan-2-ylsulfonyl-1H-isoindole IUPAC Name: (3E)-3-benzylidene-6-chloro-2-ethoxy-5-propan-2-ylsulfonyl-1H-isoindole Traditional Name: (1E)-1-benzal-5-chloro-2-ethoxy-6-isopropylsulfonyl-isoindoline Formula: C20H22ClNO3S MolecularWeight: 391.91158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClNO3S/c1-4-25-22-13-16-11-18(21)20(26(23,24)14(2)3)12-17(16)19(22)10-15-8-6-5-7-9-15/h5-12,14H,4,13H2,1-3H3/b19-10+