[2-[cyclohexen-1-yl(propyl)amino]-2-oxidanylidene-ethyl] 4-(thiophen-2-ylcarbonylamino)benzoate

Systemtic Name: [2-[cyclohexen-1-yl(propyl)amino]-2-oxidanylidene-ethyl] 4-(thiophen-2-ylcarbonylamino)benzoate Openeye Name: [2-[cyclohexen-1-yl(propyl)amino]-2-oxo-ethyl] 4-(thiophene-2-carbonylamino)benzoate CAS Name: 4-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid [2-[1-cyclohexenyl(propyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[cyclohexen-1-yl(propyl)amino]-2-oxoethyl] 4-(thiophene-2-carbonylamino)benzoate Traditional Name: 4-(2-thenoylamino)benzoic acid [2-[cyclohexen-1-yl(propyl)amino]-2-keto-ethyl] ester Formula: C23H26N2O4S MolecularWeight: 426.52854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CCCCC1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

CCCN(C1=CCCCC1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C23H26N2O4S/c1-2-14-25(19-7-4-3-5-8-19)21(26)16-29-23(28)17-10-12-18(13-11-17)24-22(27)20-9-6-15-30-20/h6-7,9-13,15H,2-5,8,14,16H2,1H3,(H,24,27)