N5-cyclooctyl-N3-methyl-4-oxidanylidene-N3-(phenylmethyl)-1-(pyridin-2-ylmethyl)pyridine-3,5-dicarboxamide

Systemtic Name: N5-cyclooctyl-N3-methyl-4-oxidanylidene-N3-(phenylmethyl)-1-(pyridin-2-ylmethyl)pyridine-3,5-dicarboxamide Openeye Name: N3-benzyl-N5-cyclooctyl-N3-methyl-4-oxo-1-(2-pyridylmethyl)pyridine-3,5-dicarboxamide CAS Name: N5-cyclooctyl-N3-methyl-4-oxo-N3-(phenylmethyl)-1-(2-pyridinylmethyl)pyridine-3,5-dicarboxamide IUPAC Name: 3-N-benzyl-5-N-cyclooctyl-3-N-methyl-4-oxo-1-(pyridin-2-ylmethyl)pyridine-3,5-dicarboxamide Traditional Name: N-benzyl-N'-cyclooctyl-4-keto-N-methyl-1-(2-pyridylmethyl)dinicotinamide Formula: C29H34N4O3 MolecularWeight: 486.60526

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2=CN(C=C(C2=O)C(=O)NC3CCCCCCC3)CC4=CC=CC=N4

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2=CN(C=C(C2=O)C(=O)NC3CCCCCCC3)CC4=CC=CC=N4

InChI

InChI=1S/C29H34N4O3/c1-32(18-22-12-6-5-7-13-22)29(36)26-21-33(19-24-16-10-11-17-30-24)20-25(27(26)34)28(35)31-23-14-8-3-2-4-9-15-23/h5-7,10-13,16-17,20-21,23H,2-4,8-9,14-15,18-19H2,1H3,(H,31,35)