6,7,10-trimethyl-3-phenethyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one

Systemtic Name: 6,7,10-trimethyl-3-phenethyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one Openeye Name: 6,7,10-trimethyl-3-phenethyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one CAS Name: 6,7,10-trimethyl-3-phenethyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one IUPAC Name: 6,7,10-trimethyl-3-phenethyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one Traditional Name: 6,7,10-trimethyl-3-phenethyl-3,4-dihydro-2H-pyrano[3,2-g][1,3]benzoxazin-3-ium-8-one Formula: C22H24NO3+ MolecularWeight: 350.43086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C(C3=C(C[NH+](CO3)CCC4=CC=CC=C4)C=C12)C)C

Isomeric SMILES

CC1=C(C(=O)OC2=C(C3=C(C[NH+](CO3)CCC4=CC=CC=C4)C=C12)C)C

InChI

InChI=1S/C22H23NO3/c1-14-15(2)22(24)26-21-16(3)20-18(11-19(14)21)12-23(13-25-20)10-9-17-7-5-4-6-8-17/h4-8,11H,9-10,12-13H2,1-3H3/p+1