methyl (E)-2-[2,5-bis(oxidanyl)phenyl]-3-(ethylamino)but-2-enoate

Systemtic Name: methyl (E)-2-[2,5-bis(oxidanyl)phenyl]-3-(ethylamino)but-2-enoate Openeye Name: methyl (E)-2-(2,5-dihydroxyphenyl)-3-(ethylamino)but-2-enoate CAS Name: (E)-2-(2,5-dihydroxyphenyl)-3-(ethylamino)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-2-(2,5-dihydroxyphenyl)-3-(ethylamino)but-2-enoate Traditional Name: (E)-2-(2,5-dihydroxyphenyl)-3-(ethylamino)but-2-enoic acid methyl ester Formula: C13H17NO4 MolecularWeight: 251.27838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=C(C1=C(C=CC(=C1)O)O)C(=O)OC)C

Isomeric SMILES

CCN/C(=C(\C1=C(C=CC(=C1)O)O)/C(=O)OC)/C

InChI

InChI=1S/C13H17NO4/c1-4-14-8(2)12(13(17)18-3)10-7-9(15)5-6-11(10)16/h5-7,14-16H,4H2,1-3H3/b12-8+