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

Systemtic Name: 3-(2,2-diphenylethyl)-6-ethyl-10-methyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one Openeye Name: 3-(2,2-diphenylethyl)-6-ethyl-10-methyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one CAS Name: 3-(2,2-diphenylethyl)-6-ethyl-10-methyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one IUPAC Name: 3-(2,2-diphenylethyl)-6-ethyl-10-methyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one Traditional Name: 3-(2,2-diphenylethyl)-6-ethyl-10-methyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one Formula: C28H28NO3+ MolecularWeight: 426.52682

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C(C3=C(C[NH+](CO3)CC(C4=CC=CC=C4)C5=CC=CC=C5)C=C12)C

Isomeric SMILES

CCC1=CC(=O)OC2=C(C3=C(C[NH+](CO3)CC(C4=CC=CC=C4)C5=CC=CC=C5)C=C12)C

InChI

InChI=1S/C28H27NO3/c1-3-20-15-26(30)32-28-19(2)27-23(14-24(20)28)16-29(18-31-27)17-25(21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-15,25H,3,16-18H2,1-2H3/p+1