(4R)-N,N-diethyl-4-piperidin-1-ium-1-yl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-amine

Systemtic Name: (4R)-N,N-diethyl-4-piperidin-1-ium-1-yl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-amine Openeye Name: (4R)-N,N-diethyl-4-piperidin-1-ium-1-yl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-amine CAS Name: (4R)-N,N-diethyl-4-(1-piperidin-1-iumyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-amine IUPAC Name: (4R)-N,N-diethyl-4-piperidin-1-ium-1-yl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-amine Traditional Name: diethyl-[(4R)-4-piperidin-1-ium-1-yl-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]amine Formula: C18H31N3+2 MolecularWeight: 289.45884

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(C[NH2+]C2)[NH+]3CCCCC3

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)[C@H](C[NH2+]C2)[NH+]3CCCCC3

InChI

InChI=1S/C18H29N3/c1-3-20(4-2)16-8-9-17-15(12-16)13-19-14-18(17)21-10-6-5-7-11-21/h8-9,12,18-19H,3-7,10-11,13-14H2,1-2H3/p+2/t18-/m0/s1