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

Systemtic Name: methyl 4-[(9-oxidanylidene-3-bicyclo[3.3.1]nonanyl)carbonylamino]benzoate Openeye Name: methyl 4-[(9-oxobicyclo[3.3.1]nonane-3-carbonyl)amino]benzoate CAS Name: 4-[[oxo-(9-oxo-3-bicyclo[3.3.1]nonanyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(9-oxobicyclo[3.3.1]nonane-3-carbonyl)amino]benzoate Traditional Name: 4-[(9-ketobicyclo[3.3.1]nonane-3-carbonyl)amino]benzoic acid methyl ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO4/c1-23-18(22)11-5-7-15(8-6-11)19-17(21)14-9-12-3-2-4-13(10-14)16(12)20/h5-8,12-14H,2-4,9-10H2,1H3,(H,19,21)