ethyl 4-[2-[1-(1-adamantylcarbamoyl)piperidin-4-yl]-6-methyl-pyridin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[1-(1-adamantylcarbamoyl)piperidin-4-yl]-6-methyl-pyridin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-[1-(1-adamantylcarbamoyl)-4-piperidyl]-6-methyl-pyridine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-[1-[(1-adamantylamino)-oxomethyl]-4-piperidinyl]-6-methyl-3-pyridinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[1-(1-adamantylcarbamoyl)piperidin-4-yl]-6-methylpyridine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-[1-(1-adamantylcarbamoyl)-4-piperidyl]-6-methyl-nicotinoyl]piperazine-1-carboxylic acid ethyl ester Formula: C30H43N5O4 MolecularWeight: 537.69352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C30H43N5O4/c1-3-39-29(38)35-12-10-33(11-13-35)27(36)25-5-4-20(2)31-26(25)24-6-8-34(9-7-24)28(37)32-30-17-21-14-22(18-30)16-23(15-21)19-30/h4-5,21-24H,3,6-19H2,1-2H3,(H,32,37)