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

Systemtic Name: ethyl 4-[2-[1-(1,3-benzodioxol-4-ylcarbonyl)piperidin-4-yl]-6-methyl-pyridin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-[1-(1,3-benzodioxole-4-carbonyl)-4-piperidyl]-6-methyl-pyridine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-[1-[1,3-benzodioxol-4-yl(oxo)methyl]-4-piperidinyl]-6-methyl-3-pyridinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[1-(1,3-benzodioxole-4-carbonyl)piperidin-4-yl]-6-methylpyridine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-[1-(1,3-benzodioxole-4-carbonyl)-4-piperidyl]-6-methyl-nicotinoyl]piperazine-1-carboxylic acid ethyl ester Formula: C27H32N4O6 MolecularWeight: 508.56618

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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=C5C(=CC=C4)OCO5

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=O)C4=C5C(=CC=C4)OCO5

InChI

InChI=1S/C27H32N4O6/c1-3-35-27(34)31-15-13-30(14-16-31)25(32)20-8-7-18(2)28-23(20)19-9-11-29(12-10-19)26(33)21-5-4-6-22-24(21)37-17-36-22/h4-8,19H,3,9-17H2,1-2H3