[3-(acetyloxymethyl)-6,7-dimethoxy-4-(1-oxidanidylpyridin-1-ium-2-yl)naphthalen-2-yl]methyl ethanoate

Systemtic Name: [3-(acetyloxymethyl)-6,7-dimethoxy-4-(1-oxidanidylpyridin-1-ium-2-yl)naphthalen-2-yl]methyl ethanoate Openeye Name: [3-(acetoxymethyl)-6,7-dimethoxy-4-(1-oxidopyridin-1-ium-2-yl)-2-naphthyl]methyl acetate CAS Name: acetic acid [3-(acetyloxymethyl)-6,7-dimethoxy-4-(1-oxido-2-pyridin-1-iumyl)-2-naphthalenyl]methyl ester IUPAC Name: [3-(acetyloxymethyl)-6,7-dimethoxy-4-(1-oxidopyridin-1-ium-2-yl)naphthalen-2-yl]methyl acetate Traditional Name: acetic acid [3-(acetoxymethyl)-6,7-dimethoxy-4-(1-oxidopyridin-1-ium-2-yl)-2-naphthyl]methyl ester Formula: C23H23NO7 MolecularWeight: 425.43122

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(C(=C2C=C(C(=CC2=C1)OC)OC)C3=CC=CC=[N+]3[O-])COC(=O)C

Isomeric SMILES

CC(=O)OCC1=C(C(=C2C=C(C(=CC2=C1)OC)OC)C3=CC=CC=[N+]3[O-])COC(=O)C

InChI

InChI=1S/C23H23NO7/c1-14(25)30-12-17-9-16-10-21(28-3)22(29-4)11-18(16)23(19(17)13-31-15(2)26)20-7-5-6-8-24(20)27/h5-11H,12-13H2,1-4H3