[7-methyl-8-(4-methyl-3-oxidanyl-pentyl)-1,4-bis(oxidanylidene)-3-propan-2-yl-naphthalen-2-yl] benzoate

Systemtic Name: [7-methyl-8-(4-methyl-3-oxidanyl-pentyl)-1,4-bis(oxidanylidene)-3-propan-2-yl-naphthalen-2-yl] benzoate Openeye Name: [8-(3-hydroxy-4-methyl-pentyl)-3-isopropyl-7-methyl-1,4-dioxo-2-naphthyl] benzoate CAS Name: benzoic acid [8-(3-hydroxy-4-methylpentyl)-7-methyl-1,4-dioxo-3-propan-2-yl-2-naphthalenyl] ester IUPAC Name: [8-(3-hydroxy-4-methylpentyl)-7-methyl-1,4-dioxo-3-propan-2-ylnaphthalen-2-yl] benzoate Traditional Name: benzoic acid [8-(3-hydroxy-4-methyl-pentyl)-3-isopropyl-1,4-diketo-7-methyl-2-naphthyl] ester Formula: C27H30O5 MolecularWeight: 434.5241

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=O)C(=C(C2=O)OC(=O)C3=CC=CC=C3)C(C)C)CCC(C(C)C)O

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=O)C(=C(C2=O)OC(=O)C3=CC=CC=C3)C(C)C)CCC(C(C)C)O

InChI

InChI=1S/C27H30O5/c1-15(2)21(28)14-13-19-17(5)11-12-20-23(19)25(30)26(22(16(3)4)24(20)29)32-27(31)18-9-7-6-8-10-18/h6-12,15-16,21,28H,13-14H2,1-5H3