N-[4-[[4-(2-hydroxyphenyl)carbonylphenyl]carbonylamino]azepan-3-yl]pyridine-4-carboxamide

Systemtic Name: N-[4-[[4-(2-hydroxyphenyl)carbonylphenyl]carbonylamino]azepan-3-yl]pyridine-4-carboxamide Openeye Name: N-[4-[[4-(2-hydroxybenzoyl)benzoyl]amino]azepan-3-yl]pyridine-4-carboxamide CAS Name: N-[4-[[[4-[(2-hydroxyphenyl)-oxomethyl]phenyl]-oxomethyl]amino]-3-azepanyl]-4-pyridinecarboxamide IUPAC Name: N-[4-[[4-(2-hydroxybenzoyl)benzoyl]amino]azepan-3-yl]pyridine-4-carboxamide Traditional Name: N-[4-[(4-salicyloylbenzoyl)amino]azepan-3-yl]isonicotinamide Formula: C26H26N4O4 MolecularWeight: 458.50904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CNC1)NC(=O)C2=CC=NC=C2)NC(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4O

Isomeric SMILES

C1CC(C(CNC1)NC(=O)C2=CC=NC=C2)NC(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4O

InChI

InChI=1S/C26H26N4O4/c31-23-6-2-1-4-20(23)24(32)17-7-9-18(10-8-17)25(33)29-21-5-3-13-28-16-22(21)30-26(34)19-11-14-27-15-12-19/h1-2,4,6-12,14-15,21-22,28,31H,3,5,13,16H2,(H,29,33)(H,30,34)