methyl 4-hex-1-ynyl-3,3-dimethyl-2-oxidanylidene-4-phenylmethoxy-cyclohexane-1-carboxylate

Systemtic Name: methyl 4-hex-1-ynyl-3,3-dimethyl-2-oxidanylidene-4-phenylmethoxy-cyclohexane-1-carboxylate Openeye Name: methyl 4-benzyloxy-4-hex-1-ynyl-3,3-dimethyl-2-oxo-cyclohexanecarboxylate CAS Name: 4-hex-1-ynyl-3,3-dimethyl-2-oxo-4-phenylmethoxy-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-hex-1-ynyl-3,3-dimethyl-2-oxo-4-phenylmethoxycyclohexane-1-carboxylate Traditional Name: 4-benzoxy-4-hex-1-ynyl-2-keto-3,3-dimethyl-cyclohexanecarboxylic acid methyl ester Formula: C23H30O4 MolecularWeight: 370.4819

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1(CCC(C(=O)C1(C)C)C(=O)OC)OCC2=CC=CC=C2

Isomeric SMILES

CCCCC#CC1(CCC(C(=O)C1(C)C)C(=O)OC)OCC2=CC=CC=C2

InChI

InChI=1S/C23H30O4/c1-5-6-7-11-15-23(27-17-18-12-9-8-10-13-18)16-14-19(21(25)26-4)20(24)22(23,2)3/h8-10,12-13,19H,5-7,14,16-17H2,1-4H3