3-[2,6-dimethoxy-4-(2-methylhexan-2-yl)phenyl]-N-quinolin-3-yl-propanamide

Systemtic Name: 3-[2,6-dimethoxy-4-(2-methylhexan-2-yl)phenyl]-N-quinolin-3-yl-propanamide Openeye Name: 3-[4-(1,1-dimethylpentyl)-2,6-dimethoxy-phenyl]-N-(3-quinolyl)propanamide CAS Name: 3-[2,6-dimethoxy-4-(2-methylhexan-2-yl)phenyl]-N-(3-quinolinyl)propanamide IUPAC Name: 3-[2,6-dimethoxy-4-(2-methylhexan-2-yl)phenyl]-N-quinolin-3-ylpropanamide Traditional Name: 3-[4-(1,1-dimethylpentyl)-2,6-dimethoxy-phenyl]-N-(3-quinolyl)propionamide Formula: C27H34N2O3 MolecularWeight: 434.57046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C1=CC(=C(C(=C1)OC)CCC(=O)NC2=CC3=CC=CC=C3N=C2)OC

Isomeric SMILES

CCCCC(C)(C)C1=CC(=C(C(=C1)OC)CCC(=O)NC2=CC3=CC=CC=C3N=C2)OC

InChI

InChI=1S/C27H34N2O3/c1-6-7-14-27(2,3)20-16-24(31-4)22(25(17-20)32-5)12-13-26(30)29-21-15-19-10-8-9-11-23(19)28-18-21/h8-11,15-18H,6-7,12-14H2,1-5H3,(H,29,30)