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

Systemtic Name: methyl 4-[[1-(2,2-dicyclohexylethanoyl)piperidin-4-ylidene]methyl]-3-methoxy-benzoate Openeye Name: methyl 4-[[1-(2,2-dicyclohexylacetyl)-4-piperidylidene]methyl]-3-methoxy-benzoate CAS Name: 4-[[1-(2,2-dicyclohexyl-1-oxoethyl)-4-piperidinylidene]methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[1-(2,2-dicyclohexylacetyl)piperidin-4-ylidene]methyl]-3-methoxybenzoate Traditional Name: 4-[[1-(2,2-dicyclohexylacetyl)-4-piperidylidene]methyl]-3-methoxy-benzoic acid methyl ester Formula: C29H41NO4 MolecularWeight: 467.64014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)C=C2CCN(CC2)C(=O)C(C3CCCCC3)C4CCCCC4

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)C=C2CCN(CC2)C(=O)C(C3CCCCC3)C4CCCCC4

InChI

InChI=1S/C29H41NO4/c1-33-26-20-25(29(32)34-2)14-13-24(26)19-21-15-17-30(18-16-21)28(31)27(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h13-14,19-20,22-23,27H,3-12,15-18H2,1-2H3