4-(2-methylpentanoyl)-N-[(4-methylphenyl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-(2-methylpentanoyl)-N-[(4-methylphenyl)methyl]piperazine-1-carboxamide Openeye Name: 4-(2-methylpentanoyl)-N-(p-tolylmethyl)piperazine-1-carboxamide CAS Name: 4-(2-methyl-1-oxopentyl)-N-[(4-methylphenyl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-(2-methylpentanoyl)-N-[(4-methylphenyl)methyl]piperazine-1-carboxamide Traditional Name: N-(4-methylbenzyl)-4-(2-methylpentanoyl)piperazine-1-carboxamide Formula: C19H29N3O2 MolecularWeight: 331.45246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(=O)N1CCN(CC1)C(=O)NCC2=CC=C(C=C2)C

Isomeric SMILES

CCCC(C)C(=O)N1CCN(CC1)C(=O)NCC2=CC=C(C=C2)C

InChI

InChI=1S/C19H29N3O2/c1-4-5-16(3)18(23)21-10-12-22(13-11-21)19(24)20-14-17-8-6-15(2)7-9-17/h6-9,16H,4-5,10-14H2,1-3H3,(H,20,24)