5-[5-methoxy-2-(3-phenoxypropoxy)phenyl]carbonyl-1-(3-methoxypropyl)-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 5-[5-methoxy-2-(3-phenoxypropoxy)phenyl]carbonyl-1-(3-methoxypropyl)-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 5-[5-methoxy-2-(3-phenoxypropoxy)benzoyl]-1-(3-methoxypropyl)-2-oxo-pyridine-3-carbonitrile CAS Name: 5-[[5-methoxy-2-(3-phenoxypropoxy)phenyl]-oxomethyl]-1-(3-methoxypropyl)-2-oxo-3-pyridinecarbonitrile IUPAC Name: 5-[5-methoxy-2-(3-phenoxypropoxy)benzoyl]-1-(3-methoxypropyl)-2-oxopyridine-3-carbonitrile Traditional Name: 2-keto-5-[5-methoxy-2-(3-phenoxypropoxy)benzoyl]-1-(3-methoxypropyl)nicotinonitrile Formula: C27H28N2O6 MolecularWeight: 476.52102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C=C(C=C(C1=O)C#N)C(=O)C2=C(C=CC(=C2)OC)OCCCOC3=CC=CC=C3

Isomeric SMILES

COCCCN1C=C(C=C(C1=O)C#N)C(=O)C2=C(C=CC(=C2)OC)OCCCOC3=CC=CC=C3

InChI

InChI=1S/C27H28N2O6/c1-32-13-6-12-29-19-21(16-20(18-28)27(29)31)26(30)24-17-23(33-2)10-11-25(24)35-15-7-14-34-22-8-4-3-5-9-22/h3-5,8-11,16-17,19H,6-7,12-15H2,1-2H3