N-[(Z)-3-[4-(1-adamantyl)-3-chloranyl-phenyl]prop-2-enyl]-N-ethyl-cyclohexanamine

Systemtic Name: N-[(Z)-3-[4-(1-adamantyl)-3-chloranyl-phenyl]prop-2-enyl]-N-ethyl-cyclohexanamine Openeye Name: N-[(Z)-3-[4-(1-adamantyl)-3-chloro-phenyl]allyl]-N-ethyl-cyclohexanamine CAS Name: N-[(Z)-3-[4-(1-adamantyl)-3-chlorophenyl]prop-2-enyl]-N-ethylcyclohexanamine IUPAC Name: N-[(Z)-3-[4-(1-adamantyl)-3-chlorophenyl]prop-2-enyl]-N-ethylcyclohexanamine Traditional Name: [(Z)-3-[4-(1-adamantyl)-3-chloro-phenyl]allyl]-cyclohexyl-ethyl-amine Formula: C27H38ClN MolecularWeight: 412.05032

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC=CC1=CC(=C(C=C1)C23CC4CC(C2)CC(C4)C3)Cl)C5CCCCC5

Isomeric SMILES

CCN(C/C=C\C1=CC(=C(C=C1)C23CC4CC(C2)CC(C4)C3)Cl)C5CCCCC5

InChI

InChI=1S/C27H38ClN/c1-2-29(24-8-4-3-5-9-24)12-6-7-20-10-11-25(26(28)16-20)27-17-21-13-22(18-27)15-23(14-21)19-27/h6-7,10-11,16,21-24H,2-5,8-9,12-15,17-19H2,1H3/b7-6-