N-[[2-(dimethylamino)-5-(3-methylbutanoylamino)phenyl]methyl]-3-methyl-N-propyl-benzamide

Systemtic Name: N-[[2-(dimethylamino)-5-(3-methylbutanoylamino)phenyl]methyl]-3-methyl-N-propyl-benzamide Openeye Name: N-[[2-(dimethylamino)-5-(3-methylbutanoylamino)phenyl]methyl]-3-methyl-N-propyl-benzamide CAS Name: N-[[2-(dimethylamino)-5-[(3-methyl-1-oxobutyl)amino]phenyl]methyl]-3-methyl-N-propylbenzamide IUPAC Name: N-[[2-(dimethylamino)-5-(3-methylbutanoylamino)phenyl]methyl]-3-methyl-N-propylbenzamide Traditional Name: N-[2-(dimethylamino)-5-(isovalerylamino)benzyl]-3-methyl-N-propyl-benzamide Formula: C25H35N3O2 MolecularWeight: 409.5643

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=C(C=CC(=C1)NC(=O)CC(C)C)N(C)C)C(=O)C2=CC(=CC=C2)C

Isomeric SMILES

CCCN(CC1=C(C=CC(=C1)NC(=O)CC(C)C)N(C)C)C(=O)C2=CC(=CC=C2)C

InChI

InChI=1S/C25H35N3O2/c1-7-13-28(25(30)20-10-8-9-19(4)15-20)17-21-16-22(11-12-23(21)27(5)6)26-24(29)14-18(2)3/h8-12,15-16,18H,7,13-14,17H2,1-6H3,(H,26,29)