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

Systemtic Name: 4-methyl-9-(3-propan-2-yloxypropyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Openeye Name: 9-(3-isopropoxypropyl)-4-methyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one CAS Name: 4-methyl-9-(3-propan-2-yloxypropyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one IUPAC Name: 4-methyl-9-(3-propan-2-yloxypropyl)-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Traditional Name: 9-(3-isopropoxypropyl)-4-methyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Formula: C18H24NO4+ MolecularWeight: 318.38746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC3=C2C[NH+](CO3)CCCOC(C)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC3=C2C[NH+](CO3)CCCOC(C)C

InChI

InChI=1S/C18H23NO4/c1-12(2)21-8-4-7-19-10-15-16(22-11-19)6-5-14-13(3)9-17(20)23-18(14)15/h5-6,9,12H,4,7-8,10-11H2,1-3H3/p+1