2-(1,3-benzodioxol-5-yl)ethyl-[(2-oxidanylidene-8-propan-2-yl-1H-quinolin-3-yl)methyl]azanium

Systemtic Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(2-oxidanylidene-8-propan-2-yl-1H-quinolin-3-yl)methyl]azanium Openeye Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(8-isopropyl-2-oxo-1H-quinolin-3-yl)methyl]ammonium CAS Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(2-oxo-8-propan-2-yl-1H-quinolin-3-yl)methyl]ammonium IUPAC Name: 2-(1,3-benzodioxol-5-yl)ethyl-[(2-oxo-8-propan-2-yl-1H-quinolin-3-yl)methyl]azanium Traditional Name: homopiperonyl-[(8-isopropyl-2-keto-1H-quinolin-3-yl)methyl]ammonium Formula: C22H25N2O3+ MolecularWeight: 365.4455

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC2=C1NC(=O)C(=C2)C[NH2+]CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)C1=CC=CC2=C1NC(=O)C(=C2)C[NH2+]CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H24N2O3/c1-14(2)18-5-3-4-16-11-17(22(25)24-21(16)18)12-23-9-8-15-6-7-19-20(10-15)27-13-26-19/h3-7,10-11,14,23H,8-9,12-13H2,1-2H3,(H,24,25)/p+1