(Z)-6-[(3S,4S)-4-(2-hydroxyphenyl)-1-(phenylmethyl)pyrrolidin-3-yl]hex-4-enoic acid

Systemtic Name: (Z)-6-[(3S,4S)-4-(2-hydroxyphenyl)-1-(phenylmethyl)pyrrolidin-3-yl]hex-4-enoic acid Openeye Name: (Z)-6-[(3S,4S)-1-benzyl-4-(2-hydroxyphenyl)pyrrolidin-3-yl]hex-4-enoic acid CAS Name: (Z)-6-[(3S,4S)-4-(2-hydroxyphenyl)-1-(phenylmethyl)-3-pyrrolidinyl]-4-hexenoic acid IUPAC Name: (Z)-6-[(3S,4S)-1-benzyl-4-(2-hydroxyphenyl)pyrrolidin-3-yl]hex-4-enoic acid Traditional Name: (Z)-6-[(3S,4S)-1-benzyl-4-(2-hydroxyphenyl)pyrrolidin-3-yl]hex-4-enoic acid Formula: C23H27NO3 MolecularWeight: 365.46538

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CN1CC2=CC=CC=C2)C3=CC=CC=C3O)CC=CCCC(=O)O

Isomeric SMILES

C1[C@H]([C@H](CN1CC2=CC=CC=C2)C3=CC=CC=C3O)C/C=C\CCC(=O)O

InChI

InChI=1S/C23H27NO3/c25-22-13-8-7-12-20(22)21-17-24(15-18-9-3-1-4-10-18)16-19(21)11-5-2-6-14-23(26)27/h1-5,7-10,12-13,19,21,25H,6,11,14-17H2,(H,26,27)/b5-2-/t19-,21+/m1/s1