methyl 3-[(3-chloranyl-2,2-dimethyl-propanoyl)amino]-4-(4-methoxyphenyl)thiophene-2-carboxylate

Systemtic Name: methyl 3-[(3-chloranyl-2,2-dimethyl-propanoyl)amino]-4-(4-methoxyphenyl)thiophene-2-carboxylate Openeye Name: methyl 3-[(3-chloro-2,2-dimethyl-propanoyl)amino]-4-(4-methoxyphenyl)thiophene-2-carboxylate CAS Name: 3-[(3-chloro-2,2-dimethyl-1-oxopropyl)amino]-4-(4-methoxyphenyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(3-chloro-2,2-dimethylpropanoyl)amino]-4-(4-methoxyphenyl)thiophene-2-carboxylate Traditional Name: 3-[(3-chloro-2,2-dimethyl-propanoyl)amino]-4-(4-methoxyphenyl)thiophene-2-carboxylic acid methyl ester Formula: C18H20ClNO4S MolecularWeight: 381.8737

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCl)C(=O)NC1=C(SC=C1C2=CC=C(C=C2)OC)C(=O)OC

Isomeric SMILES

CC(C)(CCl)C(=O)NC1=C(SC=C1C2=CC=C(C=C2)OC)C(=O)OC

InChI

InChI=1S/C18H20ClNO4S/c1-18(2,10-19)17(22)20-14-13(9-25-15(14)16(21)24-4)11-5-7-12(23-3)8-6-11/h5-9H,10H2,1-4H3,(H,20,22)