5-(5-methoxy-2-phenylmethoxy-phenyl)carbonyl-1-(3-methoxypropyl)-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 5-(5-methoxy-2-phenylmethoxy-phenyl)carbonyl-1-(3-methoxypropyl)-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 5-(2-benzyloxy-5-methoxy-benzoyl)-1-(3-methoxypropyl)-2-oxo-pyridine-3-carbonitrile CAS Name: 5-[(5-methoxy-2-phenylmethoxyphenyl)-oxomethyl]-1-(3-methoxypropyl)-2-oxo-3-pyridinecarbonitrile IUPAC Name: 5-(5-methoxy-2-phenylmethoxybenzoyl)-1-(3-methoxypropyl)-2-oxopyridine-3-carbonitrile Traditional Name: 5-(2-benzoxy-5-methoxy-benzoyl)-2-keto-1-(3-methoxypropyl)nicotinonitrile Formula: C25H24N2O5 MolecularWeight: 432.46846

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C=C(C=C(C1=O)C#N)C(=O)C2=C(C=CC(=C2)OC)OCC3=CC=CC=C3

Isomeric SMILES

COCCCN1C=C(C=C(C1=O)C#N)C(=O)C2=C(C=CC(=C2)OC)OCC3=CC=CC=C3

InChI

InChI=1S/C25H24N2O5/c1-30-12-6-11-27-16-20(13-19(15-26)25(27)29)24(28)22-14-21(31-2)9-10-23(22)32-17-18-7-4-3-5-8-18/h3-5,7-10,13-14,16H,6,11-12,17H2,1-2H3