4-(2-methylphenyl)carbonyl-N-phenethyl-piperazine-1-carboxamide

Systemtic Name: 4-(2-methylphenyl)carbonyl-N-phenethyl-piperazine-1-carboxamide Openeye Name: 4-(2-methylbenzoyl)-N-phenethyl-piperazine-1-carboxamide CAS Name: 4-[(2-methylphenyl)-oxomethyl]-N-phenethyl-1-piperazinecarboxamide IUPAC Name: 4-(2-methylbenzoyl)-N-phenethylpiperazine-1-carboxamide Traditional Name: 4-o-toluoyl-N-phenethyl-piperazine-1-carboxamide Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O2/c1-17-7-5-6-10-19(17)20(25)23-13-15-24(16-14-23)21(26)22-12-11-18-8-3-2-4-9-18/h2-10H,11-16H2,1H3,(H,22,26)