O2-tert-butyl O4-ethyl 5-[(3-methoxyphenyl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O2-tert-butyl O4-ethyl 5-[(3-methoxyphenyl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O2-tert-butyl O4-ethyl 5-[(3-methoxybenzoyl)amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[(3-methoxyphenyl)-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester IUPAC Name: 2-O-tert-butyl 4-O-ethyl 5-[(3-methoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(m-anisoylamino)-3-methyl-thiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)(C)C)NC(=O)C2=CC(=CC=C2)OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)(C)C)NC(=O)C2=CC(=CC=C2)OC

InChI

InChI=1S/C21H25NO6S/c1-7-27-19(24)15-12(2)16(20(25)28-21(3,4)5)29-18(15)22-17(23)13-9-8-10-14(11-13)26-6/h8-11H,7H2,1-6H3,(H,22,23)