methyl 3-[[1-(2,2-dicyclohexylethanoyl)piperidin-4-ylidene]methyl]benzoate

Systemtic Name: methyl 3-[[1-(2,2-dicyclohexylethanoyl)piperidin-4-ylidene]methyl]benzoate Openeye Name: methyl 3-[[1-(2,2-dicyclohexylacetyl)-4-piperidylidene]methyl]benzoate CAS Name: 3-[[1-(2,2-dicyclohexyl-1-oxoethyl)-4-piperidinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[1-(2,2-dicyclohexylacetyl)piperidin-4-ylidene]methyl]benzoate Traditional Name: 3-[[1-(2,2-dicyclohexylacetyl)-4-piperidylidene]methyl]benzoic acid methyl ester Formula: C28H39NO3 MolecularWeight: 437.61416

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C=C2CCN(CC2)C(=O)C(C3CCCCC3)C4CCCCC4

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C=C2CCN(CC2)C(=O)C(C3CCCCC3)C4CCCCC4

InChI

InChI=1S/C28H39NO3/c1-32-28(31)25-14-8-9-22(20-25)19-21-15-17-29(18-16-21)27(30)26(23-10-4-2-5-11-23)24-12-6-3-7-13-24/h8-9,14,19-20,23-24,26H,2-7,10-13,15-18H2,1H3