N,N-bis[2-(1-methylpiperidin-1-ium-1-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine

Systemtic Name: N,N-bis[2-(1-methylpiperidin-1-ium-1-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine Openeye Name: N,N-bis[2-(1-methylpiperidin-1-ium-1-yl)ethyl]tetralin-2-amine CAS Name: N,N-bis[2-(1-methyl-1-piperidin-1-iumyl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine IUPAC Name: N,N-bis[2-(1-methylpiperidin-1-ium-1-yl)ethyl]-1,2,3,4-tetrahydronaphthalen-2-amine Traditional Name: bis[2-(1-methylpiperidin-1-ium-1-yl)ethyl]-tetralin-2-yl-amine Formula: C26H45N3+2 MolecularWeight: 399.6556

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCN(CC[N+]2(CCCCC2)C)C3CCC4=CC=CC=C4C3

Isomeric SMILES

C[N+]1(CCCCC1)CCN(CC[N+]2(CCCCC2)C)C3CCC4=CC=CC=C4C3

InChI

InChI=1S/C26H45N3/c1-28(17-7-3-8-18-28)21-15-27(16-22-29(2)19-9-4-10-20-29)26-14-13-24-11-5-6-12-25(24)23-26/h5-6,11-12,26H,3-4,7-10,13-23H2,1-2H3/q+2