(3S,4R)-4-(4-methoxyphenyl)-1-(3-phenylpropanoyl)pyrrolidine-3-carboxylic acid

Systemtic Name: (3S,4R)-4-(4-methoxyphenyl)-1-(3-phenylpropanoyl)pyrrolidine-3-carboxylic acid Openeye Name: (3S,4R)-4-(4-methoxyphenyl)-1-(3-phenylpropanoyl)pyrrolidine-3-carboxylic acid CAS Name: (3S,4R)-4-(4-methoxyphenyl)-1-(1-oxo-3-phenylpropyl)-3-pyrrolidinecarboxylic acid IUPAC Name: (3S,4R)-4-(4-methoxyphenyl)-1-(3-phenylpropanoyl)pyrrolidine-3-carboxylic acid Traditional Name: (3S,4R)-1-hydrocinnamoyl-4-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CN(CC2C(=O)O)C(=O)CCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2CN(C[C@H]2C(=O)O)C(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C21H23NO4/c1-26-17-10-8-16(9-11-17)18-13-22(14-19(18)21(24)25)20(23)12-7-15-5-3-2-4-6-15/h2-6,8-11,18-19H,7,12-14H2,1H3,(H,24,25)/t18-,19+/m0/s1