3-[(4-methoxyphenyl)methyl]-3,4-dihydro-2H-isochromeno[3,4-f][1,3]benzoxazin-3-ium-6-one

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-3,4-dihydro-2H-isochromeno[3,4-f][1,3]benzoxazin-3-ium-6-one Openeye Name: 3-[(4-methoxyphenyl)methyl]-3,4-dihydro-2H-isochromeno[3,4-f][1,3]benzoxazin-3-ium-6-one CAS Name: 3-[(4-methoxyphenyl)methyl]-3,4-dihydro-2H-[2]benzopyrano[3,4-f][1,3]benzoxazin-3-ium-6-one IUPAC Name: 3-[(4-methoxyphenyl)methyl]-3,4-dihydro-2H-isochromeno[3,4-f][1,3]benzoxazin-3-ium-6-one Traditional Name: 3-p-anisyl-3,4-dihydro-2H-isochromeno[3,4-f][1,3]benzoxazin-3-ium-6-one Formula: C23H20NO4+ MolecularWeight: 374.4092

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CC3=C(C=CC4=C3OC(=O)C5=CC=CC=C45)OC2

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CC3=C(C=CC4=C3OC(=O)C5=CC=CC=C45)OC2

InChI

InChI=1S/C23H19NO4/c1-26-16-8-6-15(7-9-16)12-24-13-20-21(27-14-24)11-10-18-17-4-2-3-5-19(17)23(25)28-22(18)20/h2-11H,12-14H2,1H3/p+1