7-(4-chlorophenyl)carbonyl-2,2,4-trimethyl-4H-1,2-benzoxazin-2-ium-3-one

Systemtic Name: 7-(4-chlorophenyl)carbonyl-2,2,4-trimethyl-4H-1,2-benzoxazin-2-ium-3-one Openeye Name: 7-(4-chlorobenzoyl)-2,2,4-trimethyl-4H-1,2-benzoxazin-2-ium-3-one CAS Name: 7-[(4-chlorophenyl)-oxomethyl]-2,2,4-trimethyl-4H-1,2-benzoxazin-2-ium-3-one IUPAC Name: 7-(4-chlorobenzoyl)-2,2,4-trimethyl-4H-1,2-benzoxazin-2-ium-3-one Traditional Name: 7-(4-chlorobenzoyl)-2,2,4-trimethyl-4H-1,2-benzoxazin-2-ium-3-one Formula: C18H17ClNO3+ MolecularWeight: 330.78548

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(C=C(C=C2)C(=O)C3=CC=C(C=C3)Cl)O[N+](C1=O)(C)C

Isomeric SMILES

CC1C2=C(C=C(C=C2)C(=O)C3=CC=C(C=C3)Cl)O[N+](C1=O)(C)C

InChI

InChI=1S/C18H17ClNO3/c1-11-15-9-6-13(10-16(15)23-20(2,3)18(11)22)17(21)12-4-7-14(19)8-5-12/h4-11H,1-3H3/q+1