(E)-3-[4-[(2S)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]oxyphenyl]prop-2-enoate

Systemtic Name: (E)-3-[4-[(2S)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]oxyphenyl]prop-2-enoate Openeye Name: (E)-3-[4-[(1S)-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethoxy]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[(2S)-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]oxyphenyl]-2-propenoate IUPAC Name: (E)-3-[4-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]oxyphenyl]prop-2-enoate Traditional Name: (E)-3-[4-[(1S)-2-keto-1-methyl-2-pyrrolidino-ethoxy]phenyl]acrylate Formula: C16H18NO4- MolecularWeight: 288.31842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)OC2=CC=C(C=C2)C=CC(=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)N1CCCC1)OC2=CC=C(C=C2)/C=C/C(=O)[O-]

InChI

InChI=1S/C16H19NO4/c1-12(16(20)17-10-2-3-11-17)21-14-7-4-13(5-8-14)6-9-15(18)19/h4-9,12H,2-3,10-11H2,1H3,(H,18,19)/p-1/b9-6+/t12-/m0/s1