6-(azepan-1-ium-1-ylmethyl)-1,2,3,4-tetrahydroquinoline

Systemtic Name: 6-(azepan-1-ium-1-ylmethyl)-1,2,3,4-tetrahydroquinoline Openeye Name: 6-(azepan-1-ium-1-ylmethyl)-1,2,3,4-tetrahydroquinoline CAS Name: 6-(1-azepan-1-iumylmethyl)-1,2,3,4-tetrahydroquinoline IUPAC Name: 6-(azepan-1-ium-1-ylmethyl)-1,2,3,4-tetrahydroquinoline Traditional Name: 6-(azepan-1-ium-1-ylmethyl)-1,2,3,4-tetrahydroquinoline Formula: C16H25N2+ MolecularWeight: 245.3831

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CC2=CC3=C(C=C2)NCCC3

Isomeric SMILES

C1CCC[NH+](CC1)CC2=CC3=C(C=C2)NCCC3

InChI

InChI=1S/C16H24N2/c1-2-4-11-18(10-3-1)13-14-7-8-16-15(12-14)6-5-9-17-16/h7-8,12,17H,1-6,9-11,13H2/p+1