1-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]-2,3-dimethyl-quinazolin-3-ium-4-one

Systemtic Name: 1-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]-2,3-dimethyl-quinazolin-3-ium-4-one Openeye Name: 1-[2-(4-ethoxyphenyl)-2-oxo-ethyl]-2,3-dimethyl-quinazolin-3-ium-4-one CAS Name: 1-[2-(4-ethoxyphenyl)-2-oxoethyl]-2,3-dimethyl-4-quinazolin-3-iumone IUPAC Name: 1-[2-(4-ethoxyphenyl)-2-oxoethyl]-2,3-dimethylquinazolin-3-ium-4-one Traditional Name: 1-(2-keto-2-p-phenetyl-ethyl)-2,3-dimethyl-quinazolin-3-ium-4-one Formula: C20H21N2O3+ MolecularWeight: 337.39234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CN2C(=[N+](C(=O)C3=CC=CC=C32)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CN2C(=[N+](C(=O)C3=CC=CC=C32)C)C

InChI

InChI=1S/C20H21N2O3/c1-4-25-16-11-9-15(10-12-16)19(23)13-22-14(2)21(3)20(24)17-7-5-6-8-18(17)22/h5-12H,4,13H2,1-3H3/q+1