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[(8aR)-8a-methyl-3-propan-2-yl-2,4,5,8-tetrahydro-1H-azulen-6-yl]methyl benzoate

[(8aR)-8a-methyl-3-propan-2-yl-2,4,5,8-tetrahydro-1H-azulen-6-yl]methyl benzoate

Systemtic Name:[(8aR)-8a-methyl-3-propan-2-yl-2,4,5,8-tetrahydro-1H-azulen-6-yl]methyl benzoate
Openeye Name:[(8aR)-3-isopropyl-8a-methyl-2,4,5,8-tetrahydro-1H-azulen-6-yl]methyl benzoate
CAS Name:benzoic acid [(8aR)-8a-methyl-3-propan-2-yl-2,4,5,8-tetrahydro-1H-azulen-6-yl]methyl ester
IUPAC Name:[(8aR)-8a-methyl-3-propan-2-yl-2,4,5,8-tetrahydro-1H-azulen-6-yl]methyl benzoate
Traditional Name:benzoic acid [(8aR)-3-isopropyl-8a-methyl-2,4,5,8-tetrahydro-1H-azulen-6-yl]methyl ester
Formula: C22H28O2
MolecularWeight: 324.45652
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2CCC(=CCC2(CC1)C)COC(=O)C3=CC=CC=C3


Isomeric SMILES

CC(C)C1=C2CCC(=CC[C@]2(CC1)C)COC(=O)C3=CC=CC=C3


InChI

InChI=1S/C22H28O2/c1-16(2)19-12-14-22(3)13-11-17(9-10-20(19)22)15-24-21(23)18-7-5-4-6-8-18/h4-8,11,16H,9-10,12-15H2,1-3H3/t22-/m0/s1


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