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

Systemtic Name: hexyl 4-[(3-chloranyl-5-methoxy-1-benzothiophen-2-yl)carbonylamino]benzoate Openeye Name: hexyl 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 hexyl ester IUPAC Name: hexyl 4-[(3-chloro-5-methoxy-1-benzothiophene-2-carbonyl)amino]benzoate Traditional Name: 4-[(3-chloro-5-methoxy-benzothiophene-2-carbonyl)amino]benzoic acid hexyl ester Formula: C23H24ClNO4S MolecularWeight: 445.95896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24ClNO4S/c1-3-4-5-6-13-29-23(27)15-7-9-16(10-8-15)25-22(26)21-20(24)18-14-17(28-2)11-12-19(18)30-21/h7-12,14H,3-6,13H2,1-2H3,(H,25,26)