10-methyl-6-propyl-3-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one

Systemtic Name: 10-methyl-6-propyl-3-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one Openeye Name: 10-methyl-6-propyl-3-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one CAS Name: 10-methyl-6-propyl-3-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one IUPAC Name: 10-methyl-6-propyl-3-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one Traditional Name: 10-methyl-6-propyl-3-(3,4,5-trimethoxybenzyl)-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one Formula: C25H30NO6+ MolecularWeight: 440.5088

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C(C3=C(C[NH+](CO3)CC4=CC(=C(C(=C4)OC)OC)OC)C=C12)C

Isomeric SMILES

CCCC1=CC(=O)OC2=C(C3=C(C[NH+](CO3)CC4=CC(=C(C(=C4)OC)OC)OC)C=C12)C

InChI

InChI=1S/C25H29NO6/c1-6-7-17-11-22(27)32-24-15(2)23-18(10-19(17)24)13-26(14-31-23)12-16-8-20(28-3)25(30-5)21(9-16)29-4/h8-11H,6-7,12-14H2,1-5H3/p+1