3-(2-methoxyethyl)-10-methyl-6-phenyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one

Systemtic Name: 3-(2-methoxyethyl)-10-methyl-6-phenyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one Openeye Name: 3-(2-methoxyethyl)-10-methyl-6-phenyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one CAS Name: 3-(2-methoxyethyl)-10-methyl-6-phenyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one IUPAC Name: 3-(2-methoxyethyl)-10-methyl-6-phenyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one Traditional Name: 3-(2-methoxyethyl)-10-methyl-6-phenyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one Formula: C21H22NO4+ MolecularWeight: 352.40368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC3=C1OC[NH+](C3)CCOC)C(=CC(=O)O2)C4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC3=C1OC[NH+](C3)CCOC)C(=CC(=O)O2)C4=CC=CC=C4

InChI

InChI=1S/C21H21NO4/c1-14-20-16(12-22(13-25-20)8-9-24-2)10-18-17(11-19(23)26-21(14)18)15-6-4-3-5-7-15/h3-7,10-11H,8-9,12-13H2,1-2H3/p+1