methyl 6-methyl-4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]quinoline-2-carboxylate

Systemtic Name: methyl 6-methyl-4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]quinoline-2-carboxylate Openeye Name: methyl 4-(4-tert-butoxycarbonylpiperazin-1-yl)-6-methyl-quinoline-2-carboxylate CAS Name: 6-methyl-4-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]-2-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 6-methyl-4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]quinoline-2-carboxylate Traditional Name: 4-(4-tert-butoxycarbonylpiperazino)-6-methyl-quinaldic acid methyl ester Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2N3CCN(CC3)C(=O)OC(C)(C)C)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2N3CCN(CC3)C(=O)OC(C)(C)C)C(=O)OC

InChI

InChI=1S/C21H27N3O4/c1-14-6-7-16-15(12-14)18(13-17(22-16)19(25)27-5)23-8-10-24(11-9-23)20(26)28-21(2,3)4/h6-7,12-13H,8-11H2,1-5H3