N-butyl-N-[4-(2-methoxyphenyl)piperazin-1-yl]adamantane-1-carboxamide

Systemtic Name: N-butyl-N-[4-(2-methoxyphenyl)piperazin-1-yl]adamantane-1-carboxamide Openeye Name: N-butyl-N-[4-(2-methoxyphenyl)piperazin-1-yl]adamantane-1-carboxamide CAS Name: N-butyl-N-[4-(2-methoxyphenyl)-1-piperazinyl]-1-adamantanecarboxamide IUPAC Name: N-butyl-N-[4-(2-methoxyphenyl)piperazin-1-yl]adamantane-1-carboxamide Traditional Name: N-butyl-N-[4-(2-methoxyphenyl)piperazino]adamantane-1-carboxamide Formula: C26H39N3O2 MolecularWeight: 425.60676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(=O)C12CC3CC(C1)CC(C3)C2)N4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

CCCCN(C(=O)C12CC3CC(C1)CC(C3)C2)N4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C26H39N3O2/c1-3-4-9-29(25(30)26-17-20-14-21(18-26)16-22(15-20)19-26)28-12-10-27(11-13-28)23-7-5-6-8-24(23)31-2/h5-8,20-22H,3-4,9-19H2,1-2H3