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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC3=C2C[NH+](CO3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC3=C2C[NH+](CO3)CC4=CC=CC=C4

InChI

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