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

Systemtic Name: 3-(4-chlorophenyl)-9-cyclopropyl-4-methyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Openeye Name: 3-(4-chlorophenyl)-9-cyclopropyl-4-methyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one CAS Name: 3-(4-chlorophenyl)-9-cyclopropyl-4-methyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one IUPAC Name: 3-(4-chlorophenyl)-9-cyclopropyl-4-methyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Traditional Name: 3-(4-chlorophenyl)-9-cyclopropyl-4-methyl-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-2-one Formula: C21H19ClNO3+ MolecularWeight: 368.83346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC3=C2C[NH+](CO3)C4CC4)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC3=C2C[NH+](CO3)C4CC4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C21H18ClNO3/c1-12-16-8-9-18-17(10-23(11-25-18)15-6-7-15)20(16)26-21(24)19(12)13-2-4-14(22)5-3-13/h2-5,8-9,15H,6-7,10-11H2,1H3/p+1