N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine

Systemtic Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine Openeye Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine CAS Name: N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine IUPAC Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine Traditional Name: (1-piperidin-1-ium-1-ylcyclohexyl)methyl-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)amine Formula: C18H35N3+2 MolecularWeight: 293.4906

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=[NH+]CC1)NCC2(CCCCC2)[NH+]3CCCCC3

Isomeric SMILES

C1CCC(=[NH+]CC1)NCC2(CCCCC2)[NH+]3CCCCC3

InChI

InChI=1S/C18H33N3/c1-4-10-17(19-13-7-1)20-16-18(11-5-2-6-12-18)21-14-8-3-9-15-21/h1-16H2,(H,19,20)/p+2