3-ethoxy-4-[(3-morpholin-4-ylsulfonylphenyl)methoxy]benzenecarbonitrile

Systemtic Name: 3-ethoxy-4-[(3-morpholin-4-ylsulfonylphenyl)methoxy]benzenecarbonitrile Openeye Name: 3-ethoxy-4-[(3-morpholinosulfonylphenyl)methoxy]benzonitrile CAS Name: 3-ethoxy-4-[[3-(4-morpholinylsulfonyl)phenyl]methoxy]benzonitrile IUPAC Name: 3-ethoxy-4-[(3-morpholin-4-ylsulfonylphenyl)methoxy]benzonitrile Traditional Name: 3-ethoxy-4-(3-morpholinosulfonylbenzyl)oxy-benzonitrile Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H22N2O5S/c1-2-26-20-13-16(14-21)6-7-19(20)27-15-17-4-3-5-18(12-17)28(23,24)22-8-10-25-11-9-22/h3-7,12-13H,2,8-11,15H2,1H3