ethyl 2-[(9-oxidanylidene-3-bicyclo[3.3.1]nonanyl)carbonylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(9-oxidanylidene-3-bicyclo[3.3.1]nonanyl)carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(9-oxobicyclo[3.3.1]nonane-3-carbonyl)amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[oxo-(9-oxo-3-bicyclo[3.3.1]nonanyl)methyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(9-oxobicyclo[3.3.1]nonane-3-carbonyl)amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(9-ketobicyclo[3.3.1]nonane-3-carbonyl)amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H25NO4S MolecularWeight: 411.5139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3CC4CCCC(C3)C4=O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3CC4CCCC(C3)C4=O

InChI

InChI=1S/C23H25NO4S/c1-2-28-23(27)19-18(14-7-4-3-5-8-14)13-29-22(19)24-21(26)17-11-15-9-6-10-16(12-17)20(15)25/h3-5,7-8,13,15-17H,2,6,9-12H2,1H3,(H,24,26)