3-[4-(2-methyloctan-2-yl)-2-phenylmethoxy-phenyl]-1-prop-2-enyl-cyclohexan-1-amine

Systemtic Name: 3-[4-(2-methyloctan-2-yl)-2-phenylmethoxy-phenyl]-1-prop-2-enyl-cyclohexan-1-amine Openeye Name: 1-allyl-3-[2-benzyloxy-4-(1,1-dimethylheptyl)phenyl]cyclohexanamine CAS Name: 3-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]-1-prop-2-enyl-1-cyclohexanamine IUPAC Name: 3-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]-1-prop-2-enylcyclohexan-1-amine Traditional Name: [1-allyl-3-[2-benzoxy-4-(1,1-dimethylheptyl)phenyl]cyclohexyl]amine Formula: C31H45NO MolecularWeight: 447.6951

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CCCC(C2)(CC=C)N)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CCCC(C2)(CC=C)N)OCC3=CC=CC=C3

InChI

InChI=1S/C31H45NO/c1-5-7-8-12-20-30(3,4)27-17-18-28(26-16-13-21-31(32,23-26)19-6-2)29(22-27)33-24-25-14-10-9-11-15-25/h6,9-11,14-15,17-18,22,26H,2,5,7-8,12-13,16,19-21,23-24,32H2,1,3-4H3