N-cyclopropyl-2-[4-[[3-(4-methoxyphenyl)-1-adamantyl]carbonyl]piperazin-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[[3-(4-methoxyphenyl)-1-adamantyl]carbonyl]piperazin-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[3-(4-methoxyphenyl)adamantane-1-carbonyl]piperazin-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[[3-(4-methoxyphenyl)-1-adamantyl]-oxomethyl]-1-piperazinyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[3-(4-methoxyphenyl)adamantane-1-carbonyl]piperazin-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[3-(4-methoxyphenyl)adamantane-1-carbonyl]piperazino]acetamide Formula: C27H37N3O3 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)N5CCN(CC5)CC(=O)NC6CC6

Isomeric SMILES

COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)N5CCN(CC5)CC(=O)NC6CC6

InChI

InChI=1S/C27H37N3O3/c1-33-23-6-2-21(3-7-23)26-13-19-12-20(14-26)16-27(15-19,18-26)25(32)30-10-8-29(9-11-30)17-24(31)28-22-4-5-22/h2-3,6-7,19-20,22H,4-5,8-18H2,1H3,(H,28,31)