methyl 2-[3-(1,3-benzoxazol-2-yl)propanoyloxymethyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[3-(1,3-benzoxazol-2-yl)propanoyloxymethyl]-4-methyl-quinoline-3-carboxylate Openeye Name: methyl 2-[3-(1,3-benzoxazol-2-yl)propanoyloxymethyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[3-(1,3-benzoxazol-2-yl)-1-oxopropoxy]methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(1,3-benzoxazol-2-yl)propanoyloxymethyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[3-(1,3-benzoxazol-2-yl)propanoyloxymethyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CCC3=NC4=CC=CC=C4O3)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CCC3=NC4=CC=CC=C4O3)C(=O)OC

InChI

InChI=1S/C23H20N2O5/c1-14-15-7-3-4-8-16(15)24-18(22(14)23(27)28-2)13-29-21(26)12-11-20-25-17-9-5-6-10-19(17)30-20/h3-10H,11-13H2,1-2H3