methyl (E)-3-(1,2-diphenyl-2H-quinazolin-3-ium-3-yl)-4-methoxy-4-oxidanyl-2-oxidanylidene-but-3-enoate

Systemtic Name: methyl (E)-3-(1,2-diphenyl-2H-quinazolin-3-ium-3-yl)-4-methoxy-4-oxidanyl-2-oxidanylidene-but-3-enoate Openeye Name: methyl (E)-3-(1,2-diphenyl-2H-quinazolin-3-ium-3-yl)-4-hydroxy-4-methoxy-2-oxo-but-3-enoate CAS Name: (E)-3-(1,2-diphenyl-2H-quinazolin-3-ium-3-yl)-4-hydroxy-4-methoxy-2-oxo-3-butenoic acid methyl ester IUPAC Name: methyl (E)-3-(1,2-diphenyl-2H-quinazolin-3-ium-3-yl)-4-hydroxy-4-methoxy-2-oxobut-3-enoate Traditional Name: (E)-3-(1,2-diphenyl-2H-quinazolin-3-ium-3-yl)-4-hydroxy-2-keto-4-methoxy-but-3-enoic acid methyl ester Formula: C26H23N2O5+ MolecularWeight: 443.47122

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C(C(=O)C(=O)OC)[N+]1=CC2=CC=CC=C2N(C1C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CO/C(=C(\C(=O)C(=O)OC)/[N+]1=CC2=CC=CC=C2N(C1C3=CC=CC=C3)C4=CC=CC=C4)/O

InChI

InChI=1S/C26H22N2O5/c1-32-25(30)22(23(29)26(31)33-2)27-17-19-13-9-10-16-21(19)28(20-14-7-4-8-15-20)24(27)18-11-5-3-6-12-18/h3-17,24H,1-2H3/p+1