methyl 2-[5-[cyano-(4-methoxyphenyl)-oxidanyl-methyl]-1-methyl-pyrrol-2-yl]ethanoate

Systemtic Name: methyl 2-[5-[cyano-(4-methoxyphenyl)-oxidanyl-methyl]-1-methyl-pyrrol-2-yl]ethanoate Openeye Name: methyl 2-[5-[cyano-hydroxy-(4-methoxyphenyl)methyl]-1-methyl-pyrrol-2-yl]acetate CAS Name: 2-[5-[cyano-hydroxy-(4-methoxyphenyl)methyl]-1-methyl-2-pyrrolyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-[cyano-hydroxy-(4-methoxyphenyl)methyl]-1-methylpyrrol-2-yl]acetate Traditional Name: 2-[5-[cyano-hydroxy-(4-methoxyphenyl)methyl]-1-methyl-pyrrol-2-yl]acetic acid methyl ester Formula: C17H18N2O4 MolecularWeight: 314.33582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C(C#N)(C2=CC=C(C=C2)OC)O)CC(=O)OC

Isomeric SMILES

CN1C(=CC=C1C(C#N)(C2=CC=C(C=C2)OC)O)CC(=O)OC

InChI

InChI=1S/C17H18N2O4/c1-19-13(10-16(20)23-3)6-9-15(19)17(21,11-18)12-4-7-14(22-2)8-5-12/h4-9,21H,10H2,1-3H3