(2R,3S)-2-[(E)-but-2-enyl]-3-(phenylmethyl)butanedioic acid

Systemtic Name: (2R,3S)-2-[(E)-but-2-enyl]-3-(phenylmethyl)butanedioic acid Openeye Name: (2S,3R)-2-benzyl-3-[(E)-but-2-enyl]butanedioic acid CAS Name: (2R,3S)-2-[(E)-but-2-enyl]-3-(phenylmethyl)butanedioic acid IUPAC Name: (2S,3R)-2-benzyl-3-[(E)-but-2-enyl]butanedioic acid Traditional Name: (2S,3R)-2-benzyl-3-[(E)-but-2-enyl]succinic acid Formula: C15H18O4 MolecularWeight: 262.30102

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCC(C(CC1=CC=CC=C1)C(=O)O)C(=O)O

Isomeric SMILES

C/C=C/C[C@H]([C@H](CC1=CC=CC=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C15H18O4/c1-2-3-9-12(14(16)17)13(15(18)19)10-11-7-5-4-6-8-11/h2-8,12-13H,9-10H2,1H3,(H,16,17)(H,18,19)/b3-2+/t12-,13+/m1/s1