cyclohexyl-[1-[1-(3-phenylpropylamino)ethyl]-3,4-dihydro-2H-quinolin-1-ium-1-yl]methanone

Systemtic Name: cyclohexyl-[1-[1-(3-phenylpropylamino)ethyl]-3,4-dihydro-2H-quinolin-1-ium-1-yl]methanone Openeye Name: cyclohexyl-[1-[1-(3-phenylpropylamino)ethyl]-3,4-dihydro-2H-quinolin-1-ium-1-yl]methanone CAS Name: cyclohexyl-[1-[1-(3-phenylpropylamino)ethyl]-3,4-dihydro-2H-quinolin-1-ium-1-yl]methanone IUPAC Name: cyclohexyl-[1-[1-(3-phenylpropylamino)ethyl]-3,4-dihydro-2H-quinolin-1-ium-1-yl]methanone Traditional Name: cyclohexyl-[1-[1-(3-phenylpropylamino)ethyl]-3,4-dihydro-2H-quinolin-1-ium-1-yl]methanone Formula: C27H37N2O+ MolecularWeight: 405.59548

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Descriptors Computed from Structure

Canonical SMILES:

CC(NCCCC1=CC=CC=C1)[N+]2(CCCC3=CC=CC=C32)C(=O)C4CCCCC4

Isomeric SMILES

CC(NCCCC1=CC=CC=C1)[N+]2(CCCC3=CC=CC=C32)C(=O)C4CCCCC4

InChI

InChI=1S/C27H37N2O/c1-22(28-20-10-14-23-12-4-2-5-13-23)29(27(30)25-16-6-3-7-17-25)21-11-18-24-15-8-9-19-26(24)29/h2,4-5,8-9,12-13,15,19,22,25,28H,3,6-7,10-11,14,16-18,20-21H2,1H3/q+1