cyclohexyl 4-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]benzoate

Systemtic Name: cyclohexyl 4-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]benzoate Openeye Name: cyclohexyl 4-[(3-chlorobenzothiophene-2-carbonyl)amino]benzoate CAS Name: 4-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-[(3-chloro-1-benzothiophene-2-carbonyl)amino]benzoate Traditional Name: 4-[(3-chlorobenzothiophene-2-carbonyl)amino]benzoic acid cyclohexyl ester Formula: C22H20ClNO3S MolecularWeight: 413.9171

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C22H20ClNO3S/c23-19-17-8-4-5-9-18(17)28-20(19)21(25)24-15-12-10-14(11-13-15)22(26)27-16-6-2-1-3-7-16/h4-5,8-13,16H,1-3,6-7H2,(H,24,25)