methyl benzoate; 4,7,7-trimethylbicyclo[2.2.1]heptan-3-one

Systemtic Name: methyl benzoate; 4,7,7-trimethylbicyclo[2.2.1]heptan-3-one Openeye Name: methyl benzoate; 1,7,7-trimethylnorbornan-2-one CAS Name: benzoic acid methyl ester; 4,7,7-trimethyl-3-bicyclo[2.2.1]heptanone IUPAC Name: methyl benzoate; 4,7,7-trimethylbicyclo[2.2.1]heptan-3-one Traditional Name: benzoic acid methyl ester; camphor Formula: C18H24O3 MolecularWeight: 288.38136

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(=O)C2)C)C.COC(=O)C1=CC=CC=C1

Isomeric SMILES

CC1(C2CCC1(C(=O)C2)C)C.COC(=O)C1=CC=CC=C1

InChI

InChI=1S/C10H16O.C8H8O2/c1-9(2)7-4-5-10(9,3)8(11)6-7;1-10-8(9)7-5-3-2-4-6-7/h7H,4-6H2,1-3H3;2-6H,1H3