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

Systemtic Name: [(8aR)-8a-methyl-3-propan-2-yl-2,4,5,8-tetrahydro-1H-azulen-6-yl]methyl 3-oxidanylbenzoate Openeye Name: [(8aR)-3-isopropyl-8a-methyl-2,4,5,8-tetrahydro-1H-azulen-6-yl]methyl 3-hydroxybenzoate CAS Name: 3-hydroxybenzoic 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 3-hydroxybenzoate Traditional Name: 3-hydroxybenzoic acid [(8aR)-3-isopropyl-8a-methyl-2,4,5,8-tetrahydro-1H-azulen-6-yl]methyl ester Formula: C22H28O3 MolecularWeight: 340.45592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28O3/c1-15(2)19-10-12-22(3)11-9-16(7-8-20(19)22)14-25-21(24)17-5-4-6-18(23)13-17/h4-6,9,13,15,23H,7-8,10-12,14H2,1-3H3/t22-/m0/s1