[1-(azepan-1-ium-1-yl)-4-phenyl-cyclohexyl]methylazanium

Systemtic Name: [1-(azepan-1-ium-1-yl)-4-phenyl-cyclohexyl]methylazanium Openeye Name: [1-(azepan-1-ium-1-yl)-4-phenyl-cyclohexyl]methylammonium CAS Name: [1-(1-azepan-1-iumyl)-4-phenylcyclohexyl]methylammonium IUPAC Name: [1-(azepan-1-ium-1-yl)-4-phenylcyclohexyl]methylazanium Traditional Name: [1-(azepan-1-ium-1-yl)-4-phenyl-cyclohexyl]methylammonium Formula: C19H32N2+2 MolecularWeight: 288.47078

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)C2(CCC(CC2)C3=CC=CC=C3)C[NH3+]

Isomeric SMILES

C1CCC[NH+](CC1)C2(CCC(CC2)C3=CC=CC=C3)C[NH3+]

InChI

InChI=1S/C19H30N2/c20-16-19(21-14-6-1-2-7-15-21)12-10-18(11-13-19)17-8-4-3-5-9-17/h3-5,8-9,18H,1-2,6-7,10-16,20H2/p+2