(4-cyano-2-methoxy-phenyl) 3-morpholin-4-ylsulfonylbenzoate

Systemtic Name: (4-cyano-2-methoxy-phenyl) 3-morpholin-4-ylsulfonylbenzoate Openeye Name: (4-cyano-2-methoxy-phenyl) 3-morpholinosulfonylbenzoate CAS Name: 3-(4-morpholinylsulfonyl)benzoic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 3-morpholin-4-ylsulfonylbenzoate Traditional Name: 3-morpholinosulfonylbenzoic acid (4-cyano-2-methoxy-phenyl) ester Formula: C19H18N2O6S MolecularWeight: 402.42102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H18N2O6S/c1-25-18-11-14(13-20)5-6-17(18)27-19(22)15-3-2-4-16(12-15)28(23,24)21-7-9-26-10-8-21/h2-6,11-12H,7-10H2,1H3