3-[(4-methoxyphenyl)methyl]-11-methyl-3,4-dihydro-2H-isochromeno[3,4-f][1,3]benzoxazin-3-ium-6-one

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-11-methyl-3,4-dihydro-2H-isochromeno[3,4-f][1,3]benzoxazin-3-ium-6-one Openeye Name: 3-[(4-methoxyphenyl)methyl]-11-methyl-3,4-dihydro-2H-isochromeno[3,4-f][1,3]benzoxazin-3-ium-6-one CAS Name: 3-[(4-methoxyphenyl)methyl]-11-methyl-3,4-dihydro-2H-[2]benzopyrano[3,4-f][1,3]benzoxazin-3-ium-6-one IUPAC Name: 3-[(4-methoxyphenyl)methyl]-11-methyl-3,4-dihydro-2H-isochromeno[3,4-f][1,3]benzoxazin-3-ium-6-one Traditional Name: 11-methyl-3-p-anisyl-3,4-dihydro-2H-isochromeno[3,4-f][1,3]benzoxazin-3-ium-6-one Formula: C24H22NO4+ MolecularWeight: 388.43578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C[NH+](CO2)CC3=CC=C(C=C3)OC)C4=C1C5=CC=CC=C5C(=O)O4

Isomeric SMILES

CC1=CC2=C(C[NH+](CO2)CC3=CC=C(C=C3)OC)C4=C1C5=CC=CC=C5C(=O)O4

InChI

InChI=1S/C24H21NO4/c1-15-11-21-20(23-22(15)18-5-3-4-6-19(18)24(26)29-23)13-25(14-28-21)12-16-7-9-17(27-2)10-8-16/h3-11H,12-14H2,1-2H3/p+1