(2-chloranylquinolin-3-yl)methyl-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-ethyl-azanium

Systemtic Name: (2-chloranylquinolin-3-yl)methyl-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-ethyl-azanium Openeye Name: (2-chloro-3-quinolyl)methyl-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-ethyl]-ethyl-ammonium CAS Name: (2-chloro-3-quinolinyl)methyl-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-ethylammonium IUPAC Name: (2-chloroquinolin-3-yl)methyl-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-ethylazanium Traditional Name: (2-chloro-3-quinolyl)methyl-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-keto-ethyl]-ethyl-ammonium Formula: C22H23ClN3O3+ MolecularWeight: 412.88932

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC2=CC=CC=C2N=C1Cl)CC(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC[NH+](CC1=CC2=CC=CC=C2N=C1Cl)CC(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H22ClN3O3/c1-2-26(13-16-11-15-5-3-4-6-18(15)25-22(16)23)14-21(27)24-17-7-8-19-20(12-17)29-10-9-28-19/h3-8,11-12H,2,9-10,13-14H2,1H3,(H,24,27)/p+1