(2S,3S)-2-(4-naphthalen-2-yloxyphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid

Systemtic Name: (2S,3S)-2-(4-naphthalen-2-yloxyphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid Openeye Name: (2S,3S)-2-[4-(2-naphthyloxy)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid CAS Name: (2S,3S)-2-[4-(2-naphthalenyloxy)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid IUPAC Name: (2S,3S)-2-(4-naphthalen-2-yloxyphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid Traditional Name: (2S,3S)-2-[4-(2-naphthoxy)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid Formula: C25H18O5 MolecularWeight: 398.40742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)OC3=CC=C(C=C3)C4C(OC5=CC=CC=C5O4)C(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)OC3=CC=C(C=C3)[C@H]4[C@H](OC5=CC=CC=C5O4)C(=O)O

InChI

InChI=1S/C25H18O5/c26-25(27)24-23(29-21-7-3-4-8-22(21)30-24)17-10-12-19(13-11-17)28-20-14-9-16-5-1-2-6-18(16)15-20/h1-15,23-24H,(H,26,27)/t23-,24-/m0/s1