ethyl 2-methyl-5-octyl-6-oxidanyl-3-(1-oxidanylnaphthalen-2-yl)carbonyl-benzoate

Systemtic Name: ethyl 2-methyl-5-octyl-6-oxidanyl-3-(1-oxidanylnaphthalen-2-yl)carbonyl-benzoate Openeye Name: ethyl 2-hydroxy-5-(1-hydroxynaphthalene-2-carbonyl)-6-methyl-3-octyl-benzoate CAS Name: 2-hydroxy-5-[(1-hydroxy-2-naphthalenyl)-oxomethyl]-6-methyl-3-octylbenzoic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-5-(1-hydroxynaphthalene-2-carbonyl)-6-methyl-3-octylbenzoate Traditional Name: 2-hydroxy-5-(1-hydroxy-2-naphthoyl)-6-methyl-3-octyl-benzoic acid ethyl ester Formula: C29H34O5 MolecularWeight: 462.57726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=C(C(=C1)C(=O)C2=C(C3=CC=CC=C3C=C2)O)C)C(=O)OCC)O

Isomeric SMILES

CCCCCCCCC1=C(C(=C(C(=C1)C(=O)C2=C(C3=CC=CC=C3C=C2)O)C)C(=O)OCC)O

InChI

InChI=1S/C29H34O5/c1-4-6-7-8-9-10-14-21-18-24(19(3)25(26(21)30)29(33)34-5-2)28(32)23-17-16-20-13-11-12-15-22(20)27(23)31/h11-13,15-18,30-31H,4-10,14H2,1-3H3