2-[6-cyclobutyl-3-(3-methoxyphenyl)-2-oxidanylidene-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[6-cyclobutyl-3-(3-methoxyphenyl)-2-oxidanylidene-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[6-cyclobutyl-3-(3-methoxyphenyl)-2-oxo-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-1-yl]ethyl-dimethyl-ammonium CAS Name: 2-[6-cyclobutyl-3-(3-methoxyphenyl)-2-oxo-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-1-yl]ethyl-dimethylammonium IUPAC Name: 2-[6-cyclobutyl-3-(3-methoxyphenyl)-2-oxo-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-1-yl]ethyl-dimethylazanium Traditional Name: 2-[6-cyclobutyl-2-keto-3-(3-methoxyphenyl)-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-1-yl]ethyl-dimethyl-ammonium Formula: C23H33N3O2+2 MolecularWeight: 383.52702

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C2=C(C[NH+](CC2)C3CCC3)C=C(C1=O)C4=CC(=CC=C4)OC

Isomeric SMILES

C[NH+](C)CCN1C2=C(C[NH+](CC2)C3CCC3)C=C(C1=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C23H31N3O2/c1-24(2)12-13-26-22-10-11-25(19-7-5-8-19)16-18(22)15-21(23(26)27)17-6-4-9-20(14-17)28-3/h4,6,9,14-15,19H,5,7-8,10-13,16H2,1-3H3/p+2