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

Systemtic Name: 4-methyl-9-[(4-methylphenyl)methyl]-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Openeye Name: 4-methyl-9-(p-tolylmethyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one CAS Name: 4-methyl-9-[(4-methylphenyl)methyl]-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one IUPAC Name: 4-methyl-9-[(4-methylphenyl)methyl]-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Traditional Name: 4-methyl-9-(4-methylbenzyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Formula: C20H20NO3+ MolecularWeight: 322.3777

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CC3=C(C=CC4=C3OC(=O)C=C4C)OC2

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CC3=C(C=CC4=C3OC(=O)C=C4C)OC2

InChI

InChI=1S/C20H19NO3/c1-13-3-5-15(6-4-13)10-21-11-17-18(23-12-21)8-7-16-14(2)9-19(22)24-20(16)17/h3-9H,10-12H2,1-2H3/p+1