(1S,2R)-2-[[4-(3,4-dimethylphenyl)-3-methoxycarbonyl-5-methyl-thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1S,2R)-2-[[4-(3,4-dimethylphenyl)-3-methoxycarbonyl-5-methyl-thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1S,2R)-2-[[4-(3,4-dimethylphenyl)-3-methoxycarbonyl-5-methyl-2-thienyl]carbamoyl]cyclohexanecarboxylate CAS Name: (1S,2R)-2-[[[4-(3,4-dimethylphenyl)-3-methoxycarbonyl-5-methyl-2-thiophenyl]amino]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1S,2R)-2-[[4-(3,4-dimethylphenyl)-3-methoxycarbonyl-5-methylthiophen-2-yl]carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1S,2R)-2-[[3-carbomethoxy-4-(3,4-dimethylphenyl)-5-methyl-2-thienyl]carbamoyl]cyclohexanecarboxylate Formula: C23H26NO5S- MolecularWeight: 428.52124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C3CCCCC3C(=O)[O-])C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)[C@@H]3CCCC[C@@H]3C(=O)[O-])C)C

InChI

InChI=1S/C23H27NO5S/c1-12-9-10-15(11-13(12)2)18-14(3)30-21(19(18)23(28)29-4)24-20(25)16-7-5-6-8-17(16)22(26)27/h9-11,16-17H,5-8H2,1-4H3,(H,24,25)(H,26,27)/p-1/t16-,17+/m1/s1