methyl 5-bromanyl-2-[(1-phenylcyclopentyl)carbonylamino]benzoate

Systemtic Name: methyl 5-bromanyl-2-[(1-phenylcyclopentyl)carbonylamino]benzoate Openeye Name: methyl 5-bromo-2-[(1-phenylcyclopentanecarbonyl)amino]benzoate CAS Name: 5-bromo-2-[[oxo-(1-phenylcyclopentyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[(1-phenylcyclopentanecarbonyl)amino]benzoate Traditional Name: 5-bromo-2-[(1-phenylcyclopentanecarbonyl)amino]benzoic acid methyl ester Formula: C20H20BrNO3 MolecularWeight: 402.2817

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)NC(=O)C2(CCCC2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)NC(=O)C2(CCCC2)C3=CC=CC=C3

InChI

InChI=1S/C20H20BrNO3/c1-25-18(23)16-13-15(21)9-10-17(16)22-19(24)20(11-5-6-12-20)14-7-3-2-4-8-14/h2-4,7-10,13H,5-6,11-12H2,1H3,(H,22,24)