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

Systemtic Name: N-(1-adamantyl)-4-(5-chloranyl-2-methyl-phenyl)piperazine-1-carboxamide Openeye Name: N-(1-adamantyl)-4-(5-chloro-2-methyl-phenyl)piperazine-1-carboxamide CAS Name: N-(1-adamantyl)-4-(5-chloro-2-methylphenyl)-1-piperazinecarboxamide IUPAC Name: N-(1-adamantyl)-4-(5-chloro-2-methylphenyl)piperazine-1-carboxamide Traditional Name: N-(1-adamantyl)-4-(5-chloro-2-methyl-phenyl)piperazine-1-carboxamide Formula: C22H30ClN3O MolecularWeight: 387.9461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H30ClN3O/c1-15-2-3-19(23)11-20(15)25-4-6-26(7-5-25)21(27)24-22-12-16-8-17(13-22)10-18(9-16)14-22/h2-3,11,16-18H,4-10,12-14H2,1H3,(H,24,27)