(2S,3S)-2-[(4-phenethylphenyl)methyl]-3-(phenylmethyl)butanedioic acid

Systemtic Name: (2S,3S)-2-[(4-phenethylphenyl)methyl]-3-(phenylmethyl)butanedioic acid Openeye Name: (2S,3S)-2-benzyl-3-[(4-phenethylphenyl)methyl]butanedioic acid CAS Name: (2S,3S)-2-[(4-phenethylphenyl)methyl]-3-(phenylmethyl)butanedioic acid IUPAC Name: (2S,3S)-2-benzyl-3-[(4-phenethylphenyl)methyl]butanedioic acid Traditional Name: (2S,3S)-2-benzyl-3-(4-phenethylbenzyl)succinic acid Formula: C26H26O4 MolecularWeight: 402.48224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CC=C(C=C2)CC(C(CC3=CC=CC=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CC=C(C=C2)C[C@@H]([C@H](CC3=CC=CC=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C26H26O4/c27-25(28)23(17-21-9-5-2-6-10-21)24(26(29)30)18-22-15-13-20(14-16-22)12-11-19-7-3-1-4-8-19/h1-10,13-16,23-24H,11-12,17-18H2,(H,27,28)(H,29,30)/t23-,24-/m0/s1