butyl 4-[(4-thiophen-2-yloxan-4-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(4-thiophen-2-yloxan-4-yl)carbonylamino]benzoate Openeye Name: butyl 4-[[4-(2-thienyl)tetrahydropyran-4-carbonyl]amino]benzoate CAS Name: 4-[[oxo-(4-thiophen-2-yl-4-oxanyl)methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(4-thiophen-2-yloxane-4-carbonyl)amino]benzoate Traditional Name: 4-[[4-(2-thienyl)tetrahydropyran-4-carbonyl]amino]benzoic acid butyl ester Formula: C21H25NO4S MolecularWeight: 387.4925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2(CCOCC2)C3=CC=CS3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2(CCOCC2)C3=CC=CS3

InChI

InChI=1S/C21H25NO4S/c1-2-3-12-26-19(23)16-6-8-17(9-7-16)22-20(24)21(10-13-25-14-11-21)18-5-4-15-27-18/h4-9,15H,2-3,10-14H2,1H3,(H,22,24)