(3,7-dimethyl-3,4,4a,5,6,7-hexahydronaphthalen-2-yl) 2,5-dimethylbenzoate

Systemtic Name: (3,7-dimethyl-3,4,4a,5,6,7-hexahydronaphthalen-2-yl) 2,5-dimethylbenzoate Openeye Name: (3,7-dimethyl-3,4,4a,5,6,7-hexahydronaphthalen-2-yl) 2,5-dimethylbenzoate CAS Name: 2,5-dimethylbenzoic acid (3,7-dimethyl-3,4,4a,5,6,7-hexahydronaphthalen-2-yl) ester IUPAC Name: (3,7-dimethyl-3,4,4a,5,6,7-hexahydronaphthalen-2-yl) 2,5-dimethylbenzoate Traditional Name: 2,5-dimethylbenzoic acid (3,7-dimethyl-3,4,4a,5,6,7-hexahydronaphthalen-2-yl) ester Formula: C21H26O2 MolecularWeight: 310.42994

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2CC(C(=CC2=C1)OC(=O)C3=C(C=CC(=C3)C)C)C

Isomeric SMILES

CC1CCC2CC(C(=CC2=C1)OC(=O)C3=C(C=CC(=C3)C)C)C

InChI

InChI=1S/C21H26O2/c1-13-6-8-17-11-16(4)20(12-18(17)9-13)23-21(22)19-10-14(2)5-7-15(19)3/h5,7,9-10,12-13,16-17H,6,8,11H2,1-4H3