(4R)-4-(azepan-1-ium-1-yl)-N,N-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-amine

Systemtic Name: (4R)-4-(azepan-1-ium-1-yl)-N,N-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-amine Openeye Name: (4R)-4-(azepan-1-ium-1-yl)-N,N-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-amine CAS Name: (4R)-4-(1-azepan-1-iumyl)-N,N-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-amine IUPAC Name: (4R)-4-(azepan-1-ium-1-yl)-N,N-dimethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-amine Traditional Name: [(4R)-4-(azepan-1-ium-1-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-dimethyl-amine Formula: C17H29N3+2 MolecularWeight: 275.43226

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)C(C[NH2+]C2)[NH+]3CCCCCC3

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)[C@H](C[NH2+]C2)[NH+]3CCCCCC3

InChI

InChI=1S/C17H27N3/c1-19(2)15-7-8-16-14(11-15)12-18-13-17(16)20-9-5-3-4-6-10-20/h7-8,11,17-18H,3-6,9-10,12-13H2,1-2H3/p+2/t17-/m0/s1