ethyl (E)-2-cyano-3-[(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-(2-methoxy-5-morpholinosulfonyl-anilino)prop-2-enoate CAS Name: (E)-2-cyano-3-[2-methoxy-5-(4-morpholinylsulfonyl)anilino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-(2-methoxy-5-morpholin-4-ylsulfonylanilino)prop-2-enoate Traditional Name: (E)-2-cyano-3-(2-methoxy-5-morpholinosulfonyl-anilino)acrylic acid ethyl ester Formula: C17H21N3O6S MolecularWeight: 395.43014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)OC)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)OC)/C#N

InChI

InChI=1S/C17H21N3O6S/c1-3-26-17(21)13(11-18)12-19-15-10-14(4-5-16(15)24-2)27(22,23)20-6-8-25-9-7-20/h4-5,10,12,19H,3,6-9H2,1-2H3/b13-12+