[4-(phenylmethyl)piperazin-1-yl]-(3,5,7-trimethyl-1-adamantyl)methanone

Systemtic Name: [4-(phenylmethyl)piperazin-1-yl]-(3,5,7-trimethyl-1-adamantyl)methanone Openeye Name: (4-benzylpiperazin-1-yl)-(3,5,7-trimethyl-1-adamantyl)methanone CAS Name: [4-(phenylmethyl)-1-piperazinyl]-(3,5,7-trimethyl-1-adamantyl)methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(3,5,7-trimethyl-1-adamantyl)methanone Traditional Name: (4-benzylpiperazino)-(3,5,7-trimethyl-1-adamantyl)methanone Formula: C25H36N2O MolecularWeight: 380.56614

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3(CC(C1)(CC(C2)(C3)C(=O)N4CCN(CC4)CC5=CC=CC=C5)C)C

Isomeric SMILES

CC12CC3(CC(C1)(CC(C2)(C3)C(=O)N4CCN(CC4)CC5=CC=CC=C5)C)C

InChI

InChI=1S/C25H36N2O/c1-22-14-23(2)16-24(3,15-22)19-25(17-22,18-23)21(28)27-11-9-26(10-12-27)13-20-7-5-4-6-8-20/h4-8H,9-19H2,1-3H3