3-[6-[(4-methoxyphenyl)methyl]-4-oxidanylidene-benzo[h]quinazolin-3-yl]propanenitrile

Systemtic Name: 3-[6-[(4-methoxyphenyl)methyl]-4-oxidanylidene-benzo[h]quinazolin-3-yl]propanenitrile Openeye Name: 3-[6-[(4-methoxyphenyl)methyl]-4-oxo-benzo[h]quinazolin-3-yl]propanenitrile CAS Name: 3-[6-[(4-methoxyphenyl)methyl]-4-oxo-3-benzo[h]quinazolinyl]propanenitrile IUPAC Name: 3-[6-[(4-methoxyphenyl)methyl]-4-oxobenzo[h]quinazolin-3-yl]propanenitrile Traditional Name: 3-(4-keto-6-p-anisyl-benzo[h]quinazolin-3-yl)propionitrile Formula: C23H19N3O2 MolecularWeight: 369.41586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=CC3=C(C4=CC=CC=C42)N=CN(C3=O)CCC#N

Isomeric SMILES

COC1=CC=C(C=C1)CC2=CC3=C(C4=CC=CC=C42)N=CN(C3=O)CCC#N

InChI

InChI=1S/C23H19N3O2/c1-28-18-9-7-16(8-10-18)13-17-14-21-22(20-6-3-2-5-19(17)20)25-15-26(23(21)27)12-4-11-24/h2-3,5-10,14-15H,4,12-13H2,1H3