2-[2-[4-(1-adamantyl)phenoxy]ethanoylamino]-N-(furan-2-ylmethyl)pyridine-4-carboxamide

Systemtic Name: 2-[2-[4-(1-adamantyl)phenoxy]ethanoylamino]-N-(furan-2-ylmethyl)pyridine-4-carboxamide Openeye Name: 2-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]-N-(2-furylmethyl)pyridine-4-carboxamide CAS Name: 2-[[2-[4-(1-adamantyl)phenoxy]-1-oxoethyl]amino]-N-(2-furanylmethyl)-4-pyridinecarboxamide IUPAC Name: 2-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]-N-(furan-2-ylmethyl)pyridine-4-carboxamide Traditional Name: 2-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]-N-(2-furfuryl)isonicotinamide Formula: C29H31N3O4 MolecularWeight: 485.57414

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)OCC(=O)NC5=NC=CC(=C5)C(=O)NCC6=CC=CO6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)OCC(=O)NC5=NC=CC(=C5)C(=O)NCC6=CC=CO6

InChI

InChI=1S/C29H31N3O4/c33-27(32-26-13-22(7-8-30-26)28(34)31-17-25-2-1-9-35-25)18-36-24-5-3-23(4-6-24)29-14-19-10-20(15-29)12-21(11-19)16-29/h1-9,13,19-21H,10-12,14-18H2,(H,31,34)(H,30,32,33)