dimethyl 5-azanyl-3-[3-(3-methylphenoxy)propanoyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[3-(3-methylphenoxy)propanoyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[3-(3-methylphenoxy)propanoyloxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[3-(3-methylphenoxy)-1-oxopropoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[3-(3-methylphenoxy)propanoyloxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[3-(3-methylphenoxy)propanoyloxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C19H21NO7S MolecularWeight: 407.43754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCC(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)OCCC(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C19H21NO7S/c1-11-5-4-6-12(9-11)26-8-7-14(21)27-10-13-15(18(22)24-2)17(20)28-16(13)19(23)25-3/h4-6,9H,7-8,10,20H2,1-3H3