(E)-N-isoquinolin-5-yl-3-[3-(3-methoxyphenyl)-2,6,6-trimethyl-cyclohexen-1-yl]prop-2-enamide

Systemtic Name: (E)-N-isoquinolin-5-yl-3-[3-(3-methoxyphenyl)-2,6,6-trimethyl-cyclohexen-1-yl]prop-2-enamide Openeye Name: (E)-N-(5-isoquinolyl)-3-[3-(3-methoxyphenyl)-2,6,6-trimethyl-cyclohexen-1-yl]prop-2-enamide CAS Name: (E)-N-(5-isoquinolinyl)-3-[3-(3-methoxyphenyl)-2,6,6-trimethyl-1-cyclohexenyl]-2-propenamide IUPAC Name: (E)-N-isoquinolin-5-yl-3-[3-(3-methoxyphenyl)-2,6,6-trimethylcyclohexen-1-yl]prop-2-enamide Traditional Name: (E)-N-(5-isoquinolyl)-3-[3-(3-methoxyphenyl)-2,6,6-trimethyl-cyclohexen-1-yl]acrylamide Formula: C28H30N2O2 MolecularWeight: 426.55

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1C2=CC(=CC=C2)OC)(C)C)C=CC(=O)NC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

CC1=C(C(CCC1C2=CC(=CC=C2)OC)(C)C)/C=C/C(=O)NC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C28H30N2O2/c1-19-23(20-7-5-9-22(17-20)32-4)13-15-28(2,3)25(19)11-12-27(31)30-26-10-6-8-21-18-29-16-14-24(21)26/h5-12,14,16-18,23H,13,15H2,1-4H3,(H,30,31)/b12-11+