7-methyl-10-(pyridin-3-ylmethyl)-10,11-dihydro-9H-isochromeno[4,3-g][1,3]benzoxazin-10-ium-5-one

Systemtic Name: 7-methyl-10-(pyridin-3-ylmethyl)-10,11-dihydro-9H-isochromeno[4,3-g][1,3]benzoxazin-10-ium-5-one Openeye Name: 7-methyl-10-(3-pyridylmethyl)-10,11-dihydro-9H-isochromeno[4,3-g][1,3]benzoxazin-10-ium-5-one CAS Name: 7-methyl-10-(3-pyridinylmethyl)-10,11-dihydro-9H-[2]benzopyrano[4,3-g][1,3]benzoxazin-10-ium-5-one IUPAC Name: 7-methyl-10-(pyridin-3-ylmethyl)-10,11-dihydro-9H-isochromeno[4,3-g][1,3]benzoxazin-10-ium-5-one Traditional Name: 7-methyl-10-(3-pyridylmethyl)-10,11-dihydro-9H-isochromeno[4,3-g][1,3]benzoxazin-10-ium-5-one Formula: C22H19N2O3+ MolecularWeight: 359.39786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC3=C1OC[NH+](C3)CC4=CN=CC=C4)C5=CC=CC=C5C(=O)O2

Isomeric SMILES

CC1=C2C(=CC3=C1OC[NH+](C3)CC4=CN=CC=C4)C5=CC=CC=C5C(=O)O2

InChI

InChI=1S/C22H18N2O3/c1-14-20-16(12-24(13-26-20)11-15-5-4-8-23-10-15)9-19-17-6-2-3-7-18(17)22(25)27-21(14)19/h2-10H,11-13H2,1H3/p+1