N-(1-adamantyl)-N-[(3-methoxyphenyl)methyl]-2-(3-oxidanylidenepiperazin-1-yl)ethanamide

Systemtic Name: N-(1-adamantyl)-N-[(3-methoxyphenyl)methyl]-2-(3-oxidanylidenepiperazin-1-yl)ethanamide Openeye Name: N-(1-adamantyl)-N-[(3-methoxyphenyl)methyl]-2-(3-oxopiperazin-1-yl)acetamide CAS Name: N-(1-adamantyl)-N-[(3-methoxyphenyl)methyl]-2-(3-oxo-1-piperazinyl)acetamide IUPAC Name: N-(1-adamantyl)-N-[(3-methoxyphenyl)methyl]-2-(3-oxopiperazin-1-yl)acetamide Traditional Name: N-(1-adamantyl)-2-(3-ketopiperazino)-N-m-anisyl-acetamide Formula: C24H33N3O3 MolecularWeight: 411.53712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(C(=O)CN2CCNC(=O)C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=CC(=C1)CN(C(=O)CN2CCNC(=O)C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H33N3O3/c1-30-21-4-2-3-17(10-21)14-27(23(29)16-26-6-5-25-22(28)15-26)24-11-18-7-19(12-24)9-20(8-18)13-24/h2-4,10,18-20H,5-9,11-16H2,1H3,(H,25,28)