methyl 4-chloranyl-3-[(9-oxidanylidene-3-bicyclo[3.3.1]nonanyl)carbonylamino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[(9-oxidanylidene-3-bicyclo[3.3.1]nonanyl)carbonylamino]benzoate Openeye Name: methyl 4-chloro-3-[(9-oxobicyclo[3.3.1]nonane-3-carbonyl)amino]benzoate CAS Name: 4-chloro-3-[[oxo-(9-oxo-3-bicyclo[3.3.1]nonanyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[(9-oxobicyclo[3.3.1]nonane-3-carbonyl)amino]benzoate Traditional Name: 4-chloro-3-[(9-ketobicyclo[3.3.1]nonane-3-carbonyl)amino]benzoic acid methyl ester Formula: C18H20ClNO4 MolecularWeight: 349.8087

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2CC3CCCC(C2)C3=O

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2CC3CCCC(C2)C3=O

InChI

InChI=1S/C18H20ClNO4/c1-24-18(23)12-5-6-14(19)15(9-12)20-17(22)13-7-10-3-2-4-11(8-13)16(10)21/h5-6,9-11,13H,2-4,7-8H2,1H3,(H,20,22)