methyl 2-(1,3-benzodioxol-5-yl)-2-(10-oxidanidylacridin-10-ium-9-yl)ethanoate

Systemtic Name: methyl 2-(1,3-benzodioxol-5-yl)-2-(10-oxidanidylacridin-10-ium-9-yl)ethanoate Openeye Name: methyl 2-(1,3-benzodioxol-5-yl)-2-(10-oxidoacridin-10-ium-9-yl)acetate CAS Name: 2-(1,3-benzodioxol-5-yl)-2-(10-oxido-9-acridin-10-iumyl)acetic acid methyl ester IUPAC Name: methyl 2-(1,3-benzodioxol-5-yl)-2-(10-oxidoacridin-10-ium-9-yl)acetate Traditional Name: 2-(1,3-benzodioxol-5-yl)-2-(10-oxidoacridin-10-ium-9-yl)acetic acid methyl ester Formula: C23H17NO5 MolecularWeight: 387.38478

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC2=C(C=C1)OCO2)C3=C4C=CC=CC4=[N+](C5=CC=CC=C53)[O-]

Isomeric SMILES

COC(=O)C(C1=CC2=C(C=C1)OCO2)C3=C4C=CC=CC4=[N+](C5=CC=CC=C53)[O-]

InChI

InChI=1S/C23H17NO5/c1-27-23(25)21(14-10-11-19-20(12-14)29-13-28-19)22-15-6-2-4-8-17(15)24(26)18-9-5-3-7-16(18)22/h2-12,21H,13H2,1H3