9-[(3-methoxyphenyl)methyl]-3-phenyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one

Systemtic Name: 9-[(3-methoxyphenyl)methyl]-3-phenyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Openeye Name: 9-[(3-methoxyphenyl)methyl]-3-phenyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one CAS Name: 9-[(3-methoxyphenyl)methyl]-3-phenyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one IUPAC Name: 9-[(3-methoxyphenyl)methyl]-3-phenyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Traditional Name: 9-m-anisyl-3-phenyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Formula: C25H22NO4+ MolecularWeight: 400.44648

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+]2CC3=C(C=CC4=C3OC=C(C4=O)C5=CC=CC=C5)OC2

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+]2CC3=C(C=CC4=C3OC=C(C4=O)C5=CC=CC=C5)OC2

InChI

InChI=1S/C25H21NO4/c1-28-19-9-5-6-17(12-19)13-26-14-21-23(30-16-26)11-10-20-24(27)22(15-29-25(20)21)18-7-3-2-4-8-18/h2-12,15H,13-14,16H2,1H3/p+1