butyl 4-[(3-chloranyl-5-methoxy-1-benzothiophen-2-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(3-chloranyl-5-methoxy-1-benzothiophen-2-yl)carbonylamino]benzoate Openeye Name: butyl 4-[(3-chloro-5-methoxy-benzothiophene-2-carbonyl)amino]benzoate CAS Name: 4-[[(3-chloro-5-methoxy-1-benzothiophen-2-yl)-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(3-chloro-5-methoxy-1-benzothiophene-2-carbonyl)amino]benzoate Traditional Name: 4-[(3-chloro-5-methoxy-benzothiophene-2-carbonyl)amino]benzoic acid butyl ester Formula: C21H20ClNO4S MolecularWeight: 417.9058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=CC(=C3)OC)Cl

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=CC(=C3)OC)Cl

InChI

InChI=1S/C21H20ClNO4S/c1-3-4-11-27-21(25)13-5-7-14(8-6-13)23-20(24)19-18(22)16-12-15(26-2)9-10-17(16)28-19/h5-10,12H,3-4,11H2,1-2H3,(H,23,24)