N1,N1-dimethyl-1-(3-phenylmethoxyphenyl)-N4-prop-2-enyl-N4-propyl-cyclohexane-1,4-diamine

Systemtic Name: N1,N1-dimethyl-1-(3-phenylmethoxyphenyl)-N4-prop-2-enyl-N4-propyl-cyclohexane-1,4-diamine Openeye Name: N4-allyl-1-(3-benzyloxyphenyl)-N1,N1-dimethyl-N4-propyl-cyclohexane-1,4-diamine CAS Name: N1,N1-dimethyl-1-(3-phenylmethoxyphenyl)-N4-prop-2-enyl-N4-propylcyclohexane-1,4-diamine IUPAC Name: 1-N,1-N-dimethyl-1-(3-phenylmethoxyphenyl)-4-N-prop-2-enyl-4-N-propylcyclohexane-1,4-diamine Traditional Name: allyl-[4-(3-benzoxyphenyl)-4-(dimethylamino)cyclohexyl]-propyl-amine Formula: C27H38N2O MolecularWeight: 406.60342

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC=C)C1CCC(CC1)(C2=CC(=CC=C2)OCC3=CC=CC=C3)N(C)C

Isomeric SMILES

CCCN(CC=C)C1CCC(CC1)(C2=CC(=CC=C2)OCC3=CC=CC=C3)N(C)C

InChI

InChI=1S/C27H38N2O/c1-5-19-29(20-6-2)25-15-17-27(18-16-25,28(3)4)24-13-10-14-26(21-24)30-22-23-11-8-7-9-12-23/h5,7-14,21,25H,1,6,15-20,22H2,2-4H3