3-oxidanylpropyl-[(6-thiophen-3-yl-[1,3]dioxolo[4,5-g]quinolin-7-yl)methyl]azanium

Systemtic Name: 3-oxidanylpropyl-[(6-thiophen-3-yl-[1,3]dioxolo[4,5-g]quinolin-7-yl)methyl]azanium Openeye Name: 3-hydroxypropyl-[[6-(3-thienyl)-[1,3]dioxolo[4,5-g]quinolin-7-yl]methyl]ammonium CAS Name: 3-hydroxypropyl-[[6-(3-thiophenyl)-[1,3]dioxolo[4,5-g]quinolin-7-yl]methyl]ammonium IUPAC Name: 3-hydroxypropyl-[(6-thiophen-3-yl-[1,3]dioxolo[4,5-g]quinolin-7-yl)methyl]azanium Traditional Name: 3-hydroxypropyl-[[6-(3-thienyl)-[1,3]dioxolo[4,5-g]quinolin-7-yl]methyl]ammonium Formula: C18H19N2O3S+ MolecularWeight: 343.42006

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=CC3=CC(=C(N=C3C=C2O1)C4=CSC=C4)C[NH2+]CCCO

Isomeric SMILES

C1OC2=CC3=CC(=C(N=C3C=C2O1)C4=CSC=C4)C[NH2+]CCCO

InChI

InChI=1S/C18H18N2O3S/c21-4-1-3-19-9-14-6-13-7-16-17(23-11-22-16)8-15(13)20-18(14)12-2-5-24-10-12/h2,5-8,10,19,21H,1,3-4,9,11H2/p+1