(5-decyl-2-phenyl-pyrimidin-4-yl) 4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carboxylate

Systemtic Name: (5-decyl-2-phenyl-pyrimidin-4-yl) 4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carboxylate Openeye Name: (5-decyl-2-phenyl-pyrimidin-4-yl) 4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carboxylate CAS Name: 4-(4-methylpent-3-enyl)-1-cyclohex-3-enecarboxylic acid (5-decyl-2-phenyl-4-pyrimidinyl) ester IUPAC Name: (5-decyl-2-phenylpyrimidin-4-yl) 4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carboxylate Traditional Name: 4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carboxylic acid (5-decyl-2-phenyl-pyrimidin-4-yl) ester Formula: C33H46N2O2 MolecularWeight: 502.73054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1OC(=O)C2CCC(=CC2)CCC=C(C)C)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1OC(=O)C2CCC(=CC2)CCC=C(C)C)C3=CC=CC=C3

InChI

InChI=1S/C33H46N2O2/c1-4-5-6-7-8-9-10-12-20-30-25-34-31(28-18-13-11-14-19-28)35-32(30)37-33(36)29-23-21-27(22-24-29)17-15-16-26(2)3/h11,13-14,16,18-19,21,25,29H,4-10,12,15,17,20,22-24H2,1-3H3