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

Systemtic Name: 8-(azepan-1-ium-1-ylmethyl)-1,2,3,4-tetrahydroquinoline Openeye Name: 8-(azepan-1-ium-1-ylmethyl)-1,2,3,4-tetrahydroquinoline CAS Name: 8-(1-azepan-1-iumylmethyl)-1,2,3,4-tetrahydroquinoline IUPAC Name: 8-(azepan-1-ium-1-ylmethyl)-1,2,3,4-tetrahydroquinoline Traditional Name: 8-(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=CC=CC3=C2NCCC3

Isomeric SMILES

C1CCC[NH+](CC1)CC2=CC=CC3=C2NCCC3

InChI

InChI=1S/C16H24N2/c1-2-4-12-18(11-3-1)13-15-8-5-7-14-9-6-10-17-16(14)15/h5,7-8,17H,1-4,6,9-13H2/p+1