4-(5-chloranyl-2-methyl-phenyl)-N-hexyl-piperazine-1-carboxamide

Systemtic Name: 4-(5-chloranyl-2-methyl-phenyl)-N-hexyl-piperazine-1-carboxamide Openeye Name: 4-(5-chloro-2-methyl-phenyl)-N-hexyl-piperazine-1-carboxamide CAS Name: 4-(5-chloro-2-methylphenyl)-N-hexyl-1-piperazinecarboxamide IUPAC Name: 4-(5-chloro-2-methylphenyl)-N-hexylpiperazine-1-carboxamide Traditional Name: 4-(5-chloro-2-methyl-phenyl)-N-hexyl-piperazine-1-carboxamide Formula: C18H28ClN3O MolecularWeight: 337.88742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)N1CCN(CC1)C2=C(C=CC(=C2)Cl)C

Isomeric SMILES

CCCCCCNC(=O)N1CCN(CC1)C2=C(C=CC(=C2)Cl)C

InChI

InChI=1S/C18H28ClN3O/c1-3-4-5-6-9-20-18(23)22-12-10-21(11-13-22)17-14-16(19)8-7-15(17)2/h7-8,14H,3-6,9-13H2,1-2H3,(H,20,23)