(1S,6S)-6-[(3-ethoxycarbonyl-4-ethyl-5-methyl-thiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6S)-6-[(3-ethoxycarbonyl-4-ethyl-5-methyl-thiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6S)-6-[(3-ethoxycarbonyl-4-ethyl-5-methyl-2-thienyl)carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-6-[[(3-ethoxycarbonyl-4-ethyl-5-methyl-2-thiophenyl)amino]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6S)-6-[(3-ethoxycarbonyl-4-ethyl-5-methylthiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-6-[(3-carbethoxy-4-ethyl-5-methyl-2-thienyl)carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C18H22NO5S- MolecularWeight: 364.43598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)C2CC=CCC2C(=O)[O-])C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)[C@H]2CC=CC[C@@H]2C(=O)[O-])C

InChI

InChI=1S/C18H23NO5S/c1-4-11-10(3)25-16(14(11)18(23)24-5-2)19-15(20)12-8-6-7-9-13(12)17(21)22/h6-7,12-13H,4-5,8-9H2,1-3H3,(H,19,20)(H,21,22)/p-1/t12-,13-/m0/s1