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

Systemtic Name: N-[[2-(dimethylamino)-5-(3-methylbutanoylamino)phenyl]methyl]-N-(2-methoxyethyl)cyclopropanecarboxamide Openeye Name: N-[[2-(dimethylamino)-5-(3-methylbutanoylamino)phenyl]methyl]-N-(2-methoxyethyl)cyclopropanecarboxamide CAS Name: N-[[2-(dimethylamino)-5-[(3-methyl-1-oxobutyl)amino]phenyl]methyl]-N-(2-methoxyethyl)cyclopropanecarboxamide IUPAC Name: N-[[2-(dimethylamino)-5-(3-methylbutanoylamino)phenyl]methyl]-N-(2-methoxyethyl)cyclopropanecarboxamide Traditional Name: N-[2-(dimethylamino)-5-(isovalerylamino)benzyl]-N-(2-methoxyethyl)cyclopropanecarboxamide Formula: C21H33N3O3 MolecularWeight: 375.50502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC(=C(C=C1)N(C)C)CN(CCOC)C(=O)C2CC2

Isomeric SMILES

CC(C)CC(=O)NC1=CC(=C(C=C1)N(C)C)CN(CCOC)C(=O)C2CC2

InChI

InChI=1S/C21H33N3O3/c1-15(2)12-20(25)22-18-8-9-19(23(3)4)17(13-18)14-24(10-11-27-5)21(26)16-6-7-16/h8-9,13,15-16H,6-7,10-12,14H2,1-5H3,(H,22,25)