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

Systemtic Name: (E)-3-[4-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)oxyphenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(1-methyl-2-oxo-2-pyrrolidin-1-yl-ethoxy)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[1-oxo-1-(1-pyrrolidinyl)propan-2-yl]oxyphenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)oxyphenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(2-keto-1-methyl-2-pyrrolidino-ethoxy)phenyl]acrylic acid Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)OC2=CC=C(C=C2)C=CC(=O)O

Isomeric SMILES

CC(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)/b9-6+