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

Systemtic Name: [7-methyl-8-(4-methyl-4-oxidanyl-pentyl)-2-oxidanyl-3-propan-2-yl-naphthalen-1-yl] benzoate Openeye Name: [2-hydroxy-8-(4-hydroxy-4-methyl-pentyl)-3-isopropyl-7-methyl-1-naphthyl] benzoate CAS Name: benzoic acid [2-hydroxy-8-(4-hydroxy-4-methylpentyl)-7-methyl-3-propan-2-yl-1-naphthalenyl] ester IUPAC Name: [2-hydroxy-8-(4-hydroxy-4-methylpentyl)-7-methyl-3-propan-2-ylnaphthalen-1-yl] benzoate Traditional Name: benzoic acid [2-hydroxy-8-(4-hydroxy-4-methyl-pentyl)-3-isopropyl-7-methyl-1-naphthyl] ester Formula: C27H32O4 MolecularWeight: 420.54058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(=C(C=C2C=C1)C(C)C)O)OC(=O)C3=CC=CC=C3)CCCC(C)(C)O

Isomeric SMILES

CC1=C(C2=C(C(=C(C=C2C=C1)C(C)C)O)OC(=O)C3=CC=CC=C3)CCCC(C)(C)O

InChI

InChI=1S/C27H32O4/c1-17(2)22-16-20-14-13-18(3)21(12-9-15-27(4,5)30)23(20)25(24(22)28)31-26(29)19-10-7-6-8-11-19/h6-8,10-11,13-14,16-17,28,30H,9,12,15H2,1-5H3