N-[[2-(dimethylamino)-5-(3-methylbutanoylamino)phenyl]methyl]-N-(furan-2-ylmethyl)cyclopropanecarboxamide

Systemtic Name: N-[[2-(dimethylamino)-5-(3-methylbutanoylamino)phenyl]methyl]-N-(furan-2-ylmethyl)cyclopropanecarboxamide Openeye Name: N-[[2-(dimethylamino)-5-(3-methylbutanoylamino)phenyl]methyl]-N-(2-furylmethyl)cyclopropanecarboxamide CAS Name: N-[[2-(dimethylamino)-5-[(3-methyl-1-oxobutyl)amino]phenyl]methyl]-N-(2-furanylmethyl)cyclopropanecarboxamide IUPAC Name: N-[[2-(dimethylamino)-5-(3-methylbutanoylamino)phenyl]methyl]-N-(furan-2-ylmethyl)cyclopropanecarboxamide Traditional Name: N-[2-(dimethylamino)-5-(isovalerylamino)benzyl]-N-(2-furfuryl)cyclopropanecarboxamide Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC(=C(C=C1)N(C)C)CN(CC2=CC=CO2)C(=O)C3CC3

Isomeric SMILES

CC(C)CC(=O)NC1=CC(=C(C=C1)N(C)C)CN(CC2=CC=CO2)C(=O)C3CC3

InChI

InChI=1S/C23H31N3O3/c1-16(2)12-22(27)24-19-9-10-21(25(3)4)18(13-19)14-26(23(28)17-7-8-17)15-20-6-5-11-29-20/h5-6,9-11,13,16-17H,7-8,12,14-15H2,1-4H3,(H,24,27)