[5-(1,3-benzodioxol-5-yl)-2-[2-oxidanylidene-2-(quinolin-3-ylmethylamino)ethoxy]phenyl]methyl-diethyl-azanium

Systemtic Name: [5-(1,3-benzodioxol-5-yl)-2-[2-oxidanylidene-2-(quinolin-3-ylmethylamino)ethoxy]phenyl]methyl-diethyl-azanium Openeye Name: [5-(1,3-benzodioxol-5-yl)-2-[2-oxo-2-(3-quinolylmethylamino)ethoxy]phenyl]methyl-diethyl-ammonium CAS Name: [5-(1,3-benzodioxol-5-yl)-2-[2-oxo-2-(3-quinolinylmethylamino)ethoxy]phenyl]methyl-diethylammonium IUPAC Name: [5-(1,3-benzodioxol-5-yl)-2-[2-oxo-2-(quinolin-3-ylmethylamino)ethoxy]phenyl]methyl-diethylazanium Traditional Name: [5-(1,3-benzodioxol-5-yl)-2-[2-keto-2-(3-quinolylmethylamino)ethoxy]benzyl]-diethyl-ammonium Formula: C30H32N3O4+ MolecularWeight: 498.59278

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C=CC(=C1)C2=CC3=C(C=C2)OCO3)OCC(=O)NCC4=CC5=CC=CC=C5N=C4

Isomeric SMILES

CC[NH+](CC)CC1=C(C=CC(=C1)C2=CC3=C(C=C2)OCO3)OCC(=O)NCC4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C30H31N3O4/c1-3-33(4-2)18-25-14-22(23-10-12-28-29(15-23)37-20-36-28)9-11-27(25)35-19-30(34)32-17-21-13-24-7-5-6-8-26(24)31-16-21/h5-16H,3-4,17-20H2,1-2H3,(H,32,34)/p+1