(E)-3-ethoxy-2-methyl-3-[(2S)-1-(phenylmethyl)pyrrolidin-2-yl]prop-2-enoic acid

Systemtic Name: (E)-3-ethoxy-2-methyl-3-[(2S)-1-(phenylmethyl)pyrrolidin-2-yl]prop-2-enoic acid Openeye Name: (E)-3-[(2S)-1-benzylpyrrolidin-2-yl]-3-ethoxy-2-methyl-prop-2-enoic acid CAS Name: (E)-3-ethoxy-2-methyl-3-[(2S)-1-(phenylmethyl)-2-pyrrolidinyl]-2-propenoic acid IUPAC Name: (E)-3-[(2S)-1-benzylpyrrolidin-2-yl]-3-ethoxy-2-methylprop-2-enoic acid Traditional Name: (E)-3-[(2S)-1-benzylpyrrolidin-2-yl]-3-ethoxy-2-methyl-acrylic acid Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C)C(=O)O)C1CCCN1CC2=CC=CC=C2

Isomeric SMILES

CCO/C(=C(\C)/C(=O)O)/[C@@H]1CCCN1CC2=CC=CC=C2

InChI

InChI=1S/C17H23NO3/c1-3-21-16(13(2)17(19)20)15-10-7-11-18(15)12-14-8-5-4-6-9-14/h4-6,8-9,15H,3,7,10-12H2,1-2H3,(H,19,20)/b16-13+/t15-/m0/s1