(1S,2S)-2-[(3-methoxycarbonyl-5-methyl-thiophen-2-yl)carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1S,2S)-2-[(3-methoxycarbonyl-5-methyl-thiophen-2-yl)carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1S,2S)-2-[(3-methoxycarbonyl-5-methyl-2-thienyl)carbamoyl]cyclohexanecarboxylate CAS Name: (1S,2S)-2-[[(3-methoxycarbonyl-5-methyl-2-thiophenyl)amino]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1S,2S)-2-[(3-methoxycarbonyl-5-methylthiophen-2-yl)carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1S,2S)-2-[(3-carbomethoxy-5-methyl-2-thienyl)carbamoyl]cyclohexanecarboxylate Formula: C15H18NO5S- MolecularWeight: 324.37212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2CCCCC2C(=O)[O-])C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)[C@H]2CCCC[C@@H]2C(=O)[O-])C(=O)OC

InChI

InChI=1S/C15H19NO5S/c1-8-7-11(15(20)21-2)13(22-8)16-12(17)9-5-3-4-6-10(9)14(18)19/h7,9-10H,3-6H2,1-2H3,(H,16,17)(H,18,19)/p-1/t9-,10-/m0/s1