N-[9-[2-(tert-butylcarbamoyl)phenyl]-2-methyl-8-oxidanyl-5-oxidanylidene-7-(pyridin-3-ylmethyl)nonan-4-yl]quinoline-2-carboxamide

Systemtic Name: N-[9-[2-(tert-butylcarbamoyl)phenyl]-2-methyl-8-oxidanyl-5-oxidanylidene-7-(pyridin-3-ylmethyl)nonan-4-yl]quinoline-2-carboxamide Openeye Name: N-[6-[2-(tert-butylcarbamoyl)phenyl]-5-hydroxy-1-isobutyl-2-oxo-4-(3-pyridylmethyl)hexyl]quinoline-2-carboxamide CAS Name: N-[9-[2-[(tert-butylamino)-oxomethyl]phenyl]-8-hydroxy-2-methyl-5-oxo-7-(3-pyridinylmethyl)nonan-4-yl]-2-quinolinecarboxamide IUPAC Name: N-[9-[2-(tert-butylcarbamoyl)phenyl]-8-hydroxy-2-methyl-5-oxo-7-(pyridin-3-ylmethyl)nonan-4-yl]quinoline-2-carboxamide Traditional Name: N-[6-[2-(tert-butylcarbamoyl)phenyl]-5-hydroxy-1-isobutyl-2-keto-4-(3-pyridylmethyl)hexyl]quinaldamide Formula: C37H44N4O4 MolecularWeight: 608.76966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)CC(CC1=CN=CC=C1)C(CC2=CC=CC=C2C(=O)NC(C)(C)C)O)NC(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)CC(C(=O)CC(CC1=CN=CC=C1)C(CC2=CC=CC=C2C(=O)NC(C)(C)C)O)NC(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C37H44N4O4/c1-24(2)19-32(40-36(45)31-17-16-26-12-7-9-15-30(26)39-31)34(43)22-28(20-25-11-10-18-38-23-25)33(42)21-27-13-6-8-14-29(27)35(44)41-37(3,4)5/h6-18,23-24,28,32-33,42H,19-22H2,1-5H3,(H,40,45)(H,41,44)