3-[3-(5-cyanopent-1-ynyl)-5-methoxy-4-oxidanyl-phenyl]-N-(6-methyl-6-oxidanyl-heptan-2-yl)propanamide

Systemtic Name: 3-[3-(5-cyanopent-1-ynyl)-5-methoxy-4-oxidanyl-phenyl]-N-(6-methyl-6-oxidanyl-heptan-2-yl)propanamide Openeye Name: 3-[3-(5-cyanopent-1-ynyl)-4-hydroxy-5-methoxy-phenyl]-N-(5-hydroxy-1,5-dimethyl-hexyl)propanamide CAS Name: 3-[3-(5-cyanopent-1-ynyl)-4-hydroxy-5-methoxyphenyl]-N-(6-hydroxy-6-methylheptan-2-yl)propanamide IUPAC Name: 3-[3-(5-cyanopent-1-ynyl)-4-hydroxy-5-methoxyphenyl]-N-(6-hydroxy-6-methylheptan-2-yl)propanamide Traditional Name: 3-[3-(5-cyanopent-1-ynyl)-4-hydroxy-5-methoxy-phenyl]-N-(5-hydroxy-1,5-dimethyl-hexyl)propionamide Formula: C24H34N2O4 MolecularWeight: 414.53776

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C)O)NC(=O)CCC1=CC(=C(C(=C1)C#CCCCC#N)O)OC

Isomeric SMILES

CC(CCCC(C)(C)O)NC(=O)CCC1=CC(=C(C(=C1)C#CCCCC#N)O)OC

InChI

InChI=1S/C24H34N2O4/c1-18(10-9-14-24(2,3)29)26-22(27)13-12-19-16-20(11-7-5-6-8-15-25)23(28)21(17-19)30-4/h16-18,28-29H,5-6,8-10,12-14H2,1-4H3,(H,26,27)