diethyl 5-[2-[2-(1,3-benzoxazol-2-yl)phenyl]carbonyloxybutanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[2-[2-(1,3-benzoxazol-2-yl)phenyl]carbonyloxybutanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[2-[2-(1,3-benzoxazol-2-yl)benzoyl]oxybutanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-[[2-(1,3-benzoxazol-2-yl)phenyl]-oxomethoxy]-1-oxobutyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[2-[2-(1,3-benzoxazol-2-yl)benzoyl]oxybutanoylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[2-[2-(1,3-benzoxazol-2-yl)benzoyl]oxybutanoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C29H28N2O8S MolecularWeight: 564.60622

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C(=O)OCC)OC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4O3

Isomeric SMILES

CCC(C(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C(=O)OCC)OC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C29H28N2O8S/c1-5-20(24(32)31-26-22(28(34)36-6-2)16(4)23(40-26)29(35)37-7-3)39-27(33)18-13-9-8-12-17(18)25-30-19-14-10-11-15-21(19)38-25/h8-15,20H,5-7H2,1-4H3,(H,31,32)