4-phenylmethoxy-6-[(E)-2-(2,6,6-trimethylcyclohexen-1-yl)ethenyl]pyrimidin-2-amine

Systemtic Name: 4-phenylmethoxy-6-[(E)-2-(2,6,6-trimethylcyclohexen-1-yl)ethenyl]pyrimidin-2-amine Openeye Name: 4-benzyloxy-6-[(E)-2-(2,6,6-trimethylcyclohexen-1-yl)vinyl]pyrimidin-2-amine CAS Name: 4-phenylmethoxy-6-[(E)-2-(2,6,6-trimethyl-1-cyclohexenyl)ethenyl]-2-pyrimidinamine IUPAC Name: 4-phenylmethoxy-6-[(E)-2-(2,6,6-trimethylcyclohexen-1-yl)ethenyl]pyrimidin-2-amine Traditional Name: [4-benzoxy-6-[(E)-2-(2,6,6-trimethylcyclohexen-1-yl)vinyl]pyrimidin-2-yl]amine Formula: C22H27N3O MolecularWeight: 349.46928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C=CC2=CC(=NC(=N2)N)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(CCC1)(C)C)/C=C/C2=CC(=NC(=N2)N)OCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O/c1-16-8-7-13-22(2,3)19(16)12-11-18-14-20(25-21(23)24-18)26-15-17-9-5-4-6-10-17/h4-6,9-12,14H,7-8,13,15H2,1-3H3,(H2,23,24,25)/b12-11+