6-(1,3-benzodioxol-5-ylmethyl)-3-(3-ethanoylphenyl)-1-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-one

Systemtic Name: 6-(1,3-benzodioxol-5-ylmethyl)-3-(3-ethanoylphenyl)-1-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-one Openeye Name: 3-(3-acetylphenyl)-6-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-one CAS Name: 3-(3-acetylphenyl)-6-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-one IUPAC Name: 3-(3-acetylphenyl)-6-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-one Traditional Name: 3-(3-acetylphenyl)-1-methyl-6-piperonyl-5,6,7,8-tetrahydro-1,6-naphthyridin-6-ium-2-one Formula: C25H25N2O4+ MolecularWeight: 417.477

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC(=C1)C2=CC3=C(CC[NH+](C3)CC4=CC5=C(C=C4)OCO5)N(C2=O)C

Isomeric SMILES

CC(=O)C1=CC=CC(=C1)C2=CC3=C(CC[NH+](C3)CC4=CC5=C(C=C4)OCO5)N(C2=O)C

InChI

InChI=1S/C25H24N2O4/c1-16(28)18-4-3-5-19(11-18)21-12-20-14-27(9-8-22(20)26(2)25(21)29)13-17-6-7-23-24(10-17)31-15-30-23/h3-7,10-12H,8-9,13-15H2,1-2H3/p+1