3-[7-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]-8-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]propanenitrile

Systemtic Name: 3-[7-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]-8-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]propanenitrile Openeye Name: 3-[7-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]-8-methyl-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]propanenitrile CAS Name: 3-[7-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-8-methyl-4-oxo-3-pyrido[1,2-a]pyrimidinyl]propanenitrile IUPAC Name: 3-[7-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-8-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]propanenitrile Traditional Name: 3-[7-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]-4-keto-8-methyl-pyrido[1,2-a]pyrimidin-3-yl]propionitrile Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CN3C(=NC=C(C3=O)CCC#N)C=C2C

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CN3C(=NC=C(C3=O)CCC#N)C=C2C

InChI

InChI=1S/C24H25N3O4/c1-4-6-20-21(9-8-19(16(3)28)23(20)29)31-14-18-13-27-22(11-15(18)2)26-12-17(24(27)30)7-5-10-25/h8-9,11-13,29H,4-7,14H2,1-3H3