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

Systemtic Name: (8a-methyl-3-propan-2-yl-2,4,5,8-tetrahydro-1H-azulen-6-yl)methyl 4-oxidanylbenzoate Openeye Name: (3-isopropyl-8a-methyl-2,4,5,8-tetrahydro-1H-azulen-6-yl)methyl 4-hydroxybenzoate CAS Name: 4-hydroxybenzoic acid (8a-methyl-3-propan-2-yl-2,4,5,8-tetrahydro-1H-azulen-6-yl)methyl ester IUPAC Name: (8a-methyl-3-propan-2-yl-2,4,5,8-tetrahydro-1H-azulen-6-yl)methyl 4-hydroxybenzoate Traditional Name: 4-hydroxybenzoic acid (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=C(C=C3)O

Isomeric SMILES

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

InChI

InChI=1S/C22H28O3/c1-15(2)19-11-13-22(3)12-10-16(4-9-20(19)22)14-25-21(24)17-5-7-18(23)8-6-17/h5-8,10,15,23H,4,9,11-14H2,1-3H3