3-methyl-2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]pyridine-4-carboxylic acid

Systemtic Name: 3-methyl-2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]pyridine-4-carboxylic acid Openeye Name: 2-(4-tert-butoxycarbonylpiperazin-1-yl)-3-methyl-pyridine-4-carboxylic acid CAS Name: 3-methyl-2-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]-4-pyridinecarboxylic acid IUPAC Name: 3-methyl-2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]pyridine-4-carboxylic acid Traditional Name: 2-(4-tert-butoxycarbonylpiperazino)-3-methyl-isonicotinic acid Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1N2CCN(CC2)C(=O)OC(C)(C)C)C(=O)O

Isomeric SMILES

CC1=C(C=CN=C1N2CCN(CC2)C(=O)OC(C)(C)C)C(=O)O

InChI

InChI=1S/C16H23N3O4/c1-11-12(14(20)21)5-6-17-13(11)18-7-9-19(10-8-18)15(22)23-16(2,3)4/h5-6H,7-10H2,1-4H3,(H,20,21)