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

Systemtic Name: (1S,6R)-6-[(3-aminocarbonyl-5-ethoxycarbonyl-4-methyl-thiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6R)-6-[(3-carbamoyl-5-ethoxycarbonyl-4-methyl-2-thienyl)carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-6-[[(3-carbamoyl-5-ethoxycarbonyl-4-methyl-2-thiophenyl)amino]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6R)-6-[(3-carbamoyl-5-ethoxycarbonyl-4-methylthiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-6-[(3-carbamoyl-5-carbethoxy-4-methyl-2-thienyl)carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C17H19N2O6S- MolecularWeight: 379.40756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2CC=CCC2C(=O)[O-])C(=O)N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)[O-])C(=O)N)C

InChI

InChI=1S/C17H20N2O6S/c1-3-25-17(24)12-8(2)11(13(18)20)15(26-12)19-14(21)9-6-4-5-7-10(9)16(22)23/h4-5,9-10H,3,6-7H2,1-2H3,(H2,18,20)(H,19,21)(H,22,23)/p-1/t9-,10+/m1/s1