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

Systemtic Name: methyl 4-methyl-2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyloxymethyl]quinoline-3-carboxylate Openeye Name: methyl 2-[3-(tert-butoxycarbonylamino)propanoyloxymethyl]-4-methyl-quinoline-3-carboxylate CAS Name: 4-methyl-2-[[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropoxy]methyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyloxymethyl]quinoline-3-carboxylate Traditional Name: 2-[3-(tert-butoxycarbonylamino)propanoyloxymethyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O6/c1-13-14-8-6-7-9-15(14)23-16(18(13)19(25)27-5)12-28-17(24)10-11-22-20(26)29-21(2,3)4/h6-9H,10-12H2,1-5H3,(H,22,26)