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

Systemtic Name: ethyl 4-methyl-2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyloxymethyl]quinoline-3-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C22H28N2O6 MolecularWeight: 416.46752

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CCNC(=O)OC(C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CCNC(=O)OC(C)(C)C)C

InChI

InChI=1S/C22H28N2O6/c1-6-28-20(26)19-14(2)15-9-7-8-10-16(15)24-17(19)13-29-18(25)11-12-23-21(27)30-22(3,4)5/h7-10H,6,11-13H2,1-5H3,(H,23,27)