2-[2-[4-(1-adamantyl)phenoxy]ethanoylamino]pyridine-4-carboxylic acid

Systemtic Name: 2-[2-[4-(1-adamantyl)phenoxy]ethanoylamino]pyridine-4-carboxylic acid Openeye Name: 2-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]pyridine-4-carboxylic acid CAS Name: 2-[[2-[4-(1-adamantyl)phenoxy]-1-oxoethyl]amino]-4-pyridinecarboxylic acid IUPAC Name: 2-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]pyridine-4-carboxylic acid Traditional Name: 2-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]isonicotinic acid Formula: C24H26N2O4 MolecularWeight: 406.47424

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C24H26N2O4/c27-22(26-21-10-18(23(28)29)5-6-25-21)14-30-20-3-1-19(2-4-20)24-11-15-7-16(12-24)9-17(8-15)13-24/h1-6,10,15-17H,7-9,11-14H2,(H,28,29)(H,25,26,27)