3-(3-methoxyphenyl)-2-[(E)-(1-methyl-2-oxidanylidene-indol-3-ylidene)methyl]quinazolin-4-one

Systemtic Name: 3-(3-methoxyphenyl)-2-[(E)-(1-methyl-2-oxidanylidene-indol-3-ylidene)methyl]quinazolin-4-one Openeye Name: 3-(3-methoxyphenyl)-2-[(E)-(1-methyl-2-oxo-indolin-3-ylidene)methyl]quinazolin-4-one CAS Name: 3-(3-methoxyphenyl)-2-[(E)-(1-methyl-2-oxo-3-indolylidene)methyl]-4-quinazolinone IUPAC Name: 3-(3-methoxyphenyl)-2-[(E)-(1-methyl-2-oxoindol-3-ylidene)methyl]quinazolin-4-one Traditional Name: 2-[(E)-(2-keto-1-methyl-indolin-3-ylidene)methyl]-3-(3-methoxyphenyl)quinazolin-4-one Formula: C25H19N3O3 MolecularWeight: 409.43666

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=CC3=NC4=CC=CC=C4C(=O)N3C5=CC(=CC=C5)OC)C1=O

Isomeric SMILES

CN1C2=CC=CC=C2/C(=C\C3=NC4=CC=CC=C4C(=O)N3C5=CC(=CC=C5)OC)/C1=O

InChI

InChI=1S/C25H19N3O3/c1-27-22-13-6-4-10-18(22)20(24(27)29)15-23-26-21-12-5-3-11-19(21)25(30)28(23)16-8-7-9-17(14-16)31-2/h3-15H,1-2H3/b20-15+