cyclohexyl 4-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]benzoate

Systemtic Name: cyclohexyl 4-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]benzoate Openeye Name: cyclohexyl 4-[(4,5-dibromothiophene-2-carbonyl)amino]benzoate CAS Name: 4-[[(4,5-dibromo-2-thiophenyl)-oxomethyl]amino]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-[(4,5-dibromothiophene-2-carbonyl)amino]benzoate Traditional Name: 4-[(4,5-dibromothiophene-2-carbonyl)amino]benzoic acid cyclohexyl ester Formula: C18H17Br2NO3S MolecularWeight: 487.20548

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(S3)Br)Br

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(S3)Br)Br

InChI

InChI=1S/C18H17Br2NO3S/c19-14-10-15(25-16(14)20)17(22)21-12-8-6-11(7-9-12)18(23)24-13-4-2-1-3-5-13/h6-10,13H,1-5H2,(H,21,22)