[2-[(1S)-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxidanylidene-ethyl]-pentyl-azanium

Systemtic Name: [2-[(1S)-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxidanylidene-ethyl]-pentyl-azanium Openeye Name: [2-[(1S)-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxo-ethyl]-pentyl-ammonium CAS Name: [2-[(1S)-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxoethyl]-pentylammonium IUPAC Name: [2-[(1S)-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxoethyl]-pentylazanium Traditional Name: amyl-[2-keto-2-[(1S)-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]ammonium Formula: C17H27N2O+ MolecularWeight: 275.40908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH2+]CC(=O)N1CCC2=CC=CC=C2C1C

Isomeric SMILES

CCCCC[NH2+]CC(=O)N1CCC2=CC=CC=C2[C@@H]1C

InChI

InChI=1S/C17H26N2O/c1-3-4-7-11-18-13-17(20)19-12-10-15-8-5-6-9-16(15)14(19)2/h5-6,8-9,14,18H,3-4,7,10-13H2,1-2H3/p+1/t14-/m0/s1