ethyl 4-[2-[1-(2-acetyloxy-3-methyl-phenyl)carbonylpiperidin-4-yl]-6-methyl-pyridin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[1-(2-acetyloxy-3-methyl-phenyl)carbonylpiperidin-4-yl]-6-methyl-pyridin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-[1-(2-acetoxy-3-methyl-benzoyl)-4-piperidyl]-6-methyl-pyridine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-[1-[(2-acetyloxy-3-methylphenyl)-oxomethyl]-4-piperidinyl]-6-methyl-3-pyridinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[1-(2-acetyloxy-3-methylbenzoyl)piperidin-4-yl]-6-methylpyridine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-[1-(2-acetoxy-3-methyl-benzoyl)-4-piperidyl]-6-methyl-nicotinoyl]piperazine-1-carboxylic acid ethyl ester Formula: C29H36N4O6 MolecularWeight: 536.61934

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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)C4=C(C(=CC=C4)C)OC(=O)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=O)C4=C(C(=CC=C4)C)OC(=O)C

InChI

InChI=1S/C29H36N4O6/c1-5-38-29(37)33-17-15-32(16-18-33)27(35)23-10-9-20(3)30-25(23)22-11-13-31(14-12-22)28(36)24-8-6-7-19(2)26(24)39-21(4)34/h6-10,22H,5,11-18H2,1-4H3