4-azanylidene-9-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]pyrido[1,2-a]pyrimidine-3-carbonitrile

Systemtic Name: 4-azanylidene-9-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]pyrido[1,2-a]pyrimidine-3-carbonitrile Openeye Name: 9-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]-4-imino-pyrido[1,2-a]pyrimidine-3-carbonitrile CAS Name: 9-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-4-imino-3-pyrido[1,2-a]pyrimidinecarbonitrile IUPAC Name: 9-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-4-iminopyrido[1,2-a]pyrimidine-3-carbonitrile Traditional Name: 9-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]-4-imino-pyrido[1,2-a]pyrimidine-3-carbonitrile Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC=CN3C2=NC=C(C3=N)C#N

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC=CN3C2=NC=C(C3=N)C#N

InChI

InChI=1S/C21H20N4O3/c1-3-5-17-18(8-7-16(13(2)26)19(17)27)28-12-14-6-4-9-25-20(23)15(10-22)11-24-21(14)25/h4,6-9,11,23,27H,3,5,12H2,1-2H3