(3S)-3-(4-ethoxyphenyl)-3-pyrrol-1-yl-propanoate

Systemtic Name: (3S)-3-(4-ethoxyphenyl)-3-pyrrol-1-yl-propanoate Openeye Name: (3S)-3-(4-ethoxyphenyl)-3-pyrrol-1-yl-propanoate CAS Name: (3S)-3-(4-ethoxyphenyl)-3-(1-pyrrolyl)propanoate IUPAC Name: (3S)-3-(4-ethoxyphenyl)-3-pyrrol-1-ylpropanoate Traditional Name: (3S)-3-p-phenetyl-3-pyrrol-1-yl-propionate Formula: C15H16NO3- MolecularWeight: 258.29244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(CC(=O)[O-])N2C=CC=C2

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H](CC(=O)[O-])N2C=CC=C2

InChI

InChI=1S/C15H17NO3/c1-2-19-13-7-5-12(6-8-13)14(11-15(17)18)16-9-3-4-10-16/h3-10,14H,2,11H2,1H3,(H,17,18)/p-1/t14-/m0/s1