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

Systemtic Name: 3-(4-chlorophenyl)-2-methyl-9-propan-2-yl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Openeye Name: 3-(4-chlorophenyl)-9-isopropyl-2-methyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one CAS Name: 3-(4-chlorophenyl)-2-methyl-9-propan-2-yl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one IUPAC Name: 3-(4-chlorophenyl)-2-methyl-9-propan-2-yl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Traditional Name: 3-(4-chlorophenyl)-9-isopropyl-2-methyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Formula: C21H21ClNO3+ MolecularWeight: 370.84934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C3=C(C=C2)OC[NH+](C3)C(C)C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C3=C(C=C2)OC[NH+](C3)C(C)C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H20ClNO3/c1-12(2)23-10-17-18(25-11-23)9-8-16-20(24)19(13(3)26-21(16)17)14-4-6-15(22)7-5-14/h4-9,12H,10-11H2,1-3H3/p+1