2-(1,3-benzodioxol-5-yl)-7-methoxy-1-methyl-4aH-quinolin-1-ium-4-one

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-7-methoxy-1-methyl-4aH-quinolin-1-ium-4-one Openeye Name: 2-(1,3-benzodioxol-5-yl)-7-methoxy-1-methyl-4aH-quinolin-1-ium-4-one CAS Name: 2-(1,3-benzodioxol-5-yl)-7-methoxy-1-methyl-4aH-quinolin-1-ium-4-one IUPAC Name: 2-(1,3-benzodioxol-5-yl)-7-methoxy-1-methyl-4aH-quinolin-1-ium-4-one Traditional Name: 2-(1,3-benzodioxol-5-yl)-7-methoxy-1-methyl-4aH-quinolin-1-ium-4-one Formula: C18H16NO4+ MolecularWeight: 310.32394

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=C(C=CC2C(=O)C=C1C3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

C[N+]1=C2C=C(C=CC2C(=O)C=C1C3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C18H16NO4/c1-19-14(11-3-6-17-18(7-11)23-10-22-17)9-16(20)13-5-4-12(21-2)8-15(13)19/h3-9,13H,10H2,1-2H3/q+1