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

Systemtic Name: (1R,6S)-6-[(5-ethoxycarbonyl-3-methoxycarbonyl-4-methyl-thiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-[(5-ethoxycarbonyl-3-methoxycarbonyl-4-methyl-2-thienyl)carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[[(5-ethoxycarbonyl-3-methoxycarbonyl-4-methyl-2-thiophenyl)amino]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-[(5-ethoxycarbonyl-3-methoxycarbonyl-4-methylthiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-[(5-carbethoxy-3-carbomethoxy-4-methyl-2-thienyl)carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C18H20NO7S- MolecularWeight: 394.4189

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO7S/c1-4-26-18(24)13-9(2)12(17(23)25-3)15(27-13)19-14(20)10-7-5-6-8-11(10)16(21)22/h5-6,10-11H,4,7-8H2,1-3H3,(H,19,20)(H,21,22)/p-1/t10-,11+/m0/s1