N3-cyclooctyl-4-oxidanylidene-N5-prop-2-enyl-1-(2-pyridin-2-ylethyl)pyridine-3,5-dicarboxamide

Systemtic Name: N3-cyclooctyl-4-oxidanylidene-N5-prop-2-enyl-1-(2-pyridin-2-ylethyl)pyridine-3,5-dicarboxamide Openeye Name: N5-allyl-N3-cyclooctyl-4-oxo-1-[2-(2-pyridyl)ethyl]pyridine-3,5-dicarboxamide CAS Name: N3-cyclooctyl-4-oxo-N5-prop-2-enyl-1-[2-(2-pyridinyl)ethyl]pyridine-3,5-dicarboxamide IUPAC Name: 3-N-cyclooctyl-4-oxo-5-N-prop-2-enyl-1-(2-pyridin-2-ylethyl)pyridine-3,5-dicarboxamide Traditional Name: N'-allyl-N-cyclooctyl-4-keto-1-[2-(2-pyridyl)ethyl]dinicotinamide Formula: C25H32N4O3 MolecularWeight: 436.54658

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=CN(C=C(C1=O)C(=O)NC2CCCCCCC2)CCC3=CC=CC=N3

Isomeric SMILES

C=CCNC(=O)C1=CN(C=C(C1=O)C(=O)NC2CCCCCCC2)CCC3=CC=CC=N3

InChI

InChI=1S/C25H32N4O3/c1-2-14-27-24(31)21-17-29(16-13-19-10-8-9-15-26-19)18-22(23(21)30)25(32)28-20-11-6-4-3-5-7-12-20/h2,8-10,15,17-18,20H,1,3-7,11-14,16H2,(H,27,31)(H,28,32)