1-acetyloxy-3-(hydroxymethyl)-4-phenyl-7-phenylmethoxy-naphthalene-2-carboxylic acid

Systemtic Name: 1-acetyloxy-3-(hydroxymethyl)-4-phenyl-7-phenylmethoxy-naphthalene-2-carboxylic acid Openeye Name: 1-acetoxy-7-benzyloxy-3-(hydroxymethyl)-4-phenyl-naphthalene-2-carboxylic acid CAS Name: 1-acetyloxy-3-(hydroxymethyl)-4-phenyl-7-phenylmethoxy-2-naphthalenecarboxylic acid IUPAC Name: 1-acetyloxy-3-(hydroxymethyl)-4-phenyl-7-phenylmethoxynaphthalene-2-carboxylic acid Traditional Name: 1-acetoxy-7-benzoxy-3-methylol-4-phenyl-2-naphthoic acid Formula: C27H22O6 MolecularWeight: 442.45998

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=C(C2=C1C=C(C=C2)OCC3=CC=CC=C3)C4=CC=CC=C4)CO)C(=O)O

Isomeric SMILES

CC(=O)OC1=C(C(=C(C2=C1C=C(C=C2)OCC3=CC=CC=C3)C4=CC=CC=C4)CO)C(=O)O

InChI

InChI=1S/C27H22O6/c1-17(29)33-26-22-14-20(32-16-18-8-4-2-5-9-18)12-13-21(22)24(19-10-6-3-7-11-19)23(15-28)25(26)27(30)31/h2-14,28H,15-16H2,1H3,(H,30,31)