pentan-2-yl 6-[4-(5-pentan-2-yloxycarbonylpyridin-2-yl)piperazin-1-yl]pyridine-3-carboxylate

Systemtic Name: pentan-2-yl 6-[4-(5-pentan-2-yloxycarbonylpyridin-2-yl)piperazin-1-yl]pyridine-3-carboxylate Openeye Name: 1-methylbutyl 6-[4-[5-(1-methylbutoxycarbonyl)-2-pyridyl]piperazin-1-yl]pyridine-3-carboxylate CAS Name: 6-[4-[5-[oxo(pentan-2-yloxy)methyl]-2-pyridinyl]-1-piperazinyl]-3-pyridinecarboxylic acid pentan-2-yl ester IUPAC Name: pentan-2-yl 6-[4-(5-pentan-2-yloxycarbonylpyridin-2-yl)piperazin-1-yl]pyridine-3-carboxylate Traditional Name: 6-[4-[5-(1-methylbutoxycarbonyl)-2-pyridyl]piperazino]nicotinic acid 1-methylbutyl ester Formula: C26H36N4O4 MolecularWeight: 468.58844

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)OC(=O)C1=CN=C(C=C1)N2CCN(CC2)C3=NC=C(C=C3)C(=O)OC(C)CCC

Isomeric SMILES

CCCC(C)OC(=O)C1=CN=C(C=C1)N2CCN(CC2)C3=NC=C(C=C3)C(=O)OC(C)CCC

InChI

InChI=1S/C26H36N4O4/c1-5-7-19(3)33-25(31)21-9-11-23(27-17-21)29-13-15-30(16-14-29)24-12-10-22(18-28-24)26(32)34-20(4)8-6-2/h9-12,17-20H,5-8,13-16H2,1-4H3