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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N(CC2=C(C=CC(=C2)NC(=O)CC(C)C)N(C)C)C(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N(CC2=C(C=CC(=C2)NC(=O)CC(C)C)N(C)C)C(C)C

InChI

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