(1R,2R)-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)cyclohexane-1-carboxylate

Systemtic Name: (1R,2R)-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)cyclohexane-1-carboxylate Openeye Name: (1R,2R)-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)cyclohexanecarboxylate CAS Name: (1R,2R)-2-[oxo-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)methyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2R)-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)cyclohexane-1-carboxylate Traditional Name: (1R,2R)-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)cyclohexanecarboxylate Formula: C15H19N2O3S- MolecularWeight: 307.38796

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NC2=NC3=C(S2)CCCC3)C(=O)[O-]

Isomeric SMILES

C1CC[C@H]([C@@H](C1)C(=O)NC2=NC3=C(S2)CCCC3)C(=O)[O-]

InChI

InChI=1S/C15H20N2O3S/c18-13(9-5-1-2-6-10(9)14(19)20)17-15-16-11-7-3-4-8-12(11)21-15/h9-10H,1-8H2,(H,19,20)(H,16,17,18)/p-1/t9-,10-/m1/s1