methyl 3-(1-adamantyl)-4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]benzoate

Systemtic Name: methyl 3-(1-adamantyl)-4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]benzoate Openeye Name: methyl 3-(1-adamantyl)-4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]benzoate CAS Name: 3-(1-adamantyl)-4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]benzoic acid methyl ester IUPAC Name: methyl 3-(1-adamantyl)-4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]benzoate Traditional Name: 3-(1-adamantyl)-4-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]benzoic acid methyl ester Formula: C24H32O5 MolecularWeight: 400.50788

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)COC2=C(C=C(C=C2)C(=O)OC)C34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1(OCC(O1)COC2=C(C=C(C=C2)C(=O)OC)C34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C24H32O5/c1-23(2)28-14-19(29-23)13-27-21-5-4-18(22(25)26-3)9-20(21)24-10-15-6-16(11-24)8-17(7-15)12-24/h4-5,9,15-17,19H,6-8,10-14H2,1-3H3