[1-(2-chloranylprop-2-enyl)-6,7-dimethoxy-2-oxidanylidene-quinolin-3-yl]methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [1-(2-chloranylprop-2-enyl)-6,7-dimethoxy-2-oxidanylidene-quinolin-3-yl]methyl-(thiophen-2-ylmethyl)azanium Openeye Name: [1-(2-chloroallyl)-6,7-dimethoxy-2-oxo-3-quinolyl]methyl-(2-thienylmethyl)ammonium CAS Name: [1-(2-chloroprop-2-enyl)-6,7-dimethoxy-2-oxo-3-quinolinyl]methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [1-(2-chloroprop-2-enyl)-6,7-dimethoxy-2-oxoquinolin-3-yl]methyl-(thiophen-2-ylmethyl)azanium Traditional Name: [1-(2-chloroallyl)-2-keto-6,7-dimethoxy-3-quinolyl]methyl-(2-thenyl)ammonium Formula: C20H22ClN2O3S+ MolecularWeight: 405.91828

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C(C(=O)N2CC(=C)Cl)C[NH2+]CC3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C(C(=O)N2CC(=C)Cl)C[NH2+]CC3=CC=CS3)OC

InChI

InChI=1S/C20H21ClN2O3S/c1-13(21)12-23-17-9-19(26-3)18(25-2)8-14(17)7-15(20(23)24)10-22-11-16-5-4-6-27-16/h4-9,22H,1,10-12H2,2-3H3/p+1