methyl 4-methyl-2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyloxymethyl]quinoline-3-carboxylate

Systemtic Name: methyl 4-methyl-2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyloxymethyl]quinoline-3-carboxylate Openeye Name: methyl 2-[4-(tert-butoxycarbonylamino)butanoyloxymethyl]-4-methyl-quinoline-3-carboxylate CAS Name: 4-methyl-2-[[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutoxy]methyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyloxymethyl]quinoline-3-carboxylate Traditional Name: 2-[4-(tert-butoxycarbonylamino)butanoyloxymethyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C22H28N2O6 MolecularWeight: 416.46752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CCCNC(=O)OC(C)(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CCCNC(=O)OC(C)(C)C)C(=O)OC

InChI

InChI=1S/C22H28N2O6/c1-14-15-9-6-7-10-16(15)24-17(19(14)20(26)28-5)13-29-18(25)11-8-12-23-21(27)30-22(2,3)4/h6-7,9-10H,8,11-13H2,1-5H3,(H,23,27)