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

Systemtic Name: (1R,6S)-6-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[oxo-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)methyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)cyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)cyclohex-3-ene-1-carboxylate Formula: C15H17N2O3S- MolecularWeight: 305.37208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=O)C3CC=CCC3C(=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=O)[C@H]3CC=CC[C@H]3C(=O)[O-]

InChI

InChI=1S/C15H18N2O3S/c18-13(9-5-1-2-6-10(9)14(19)20)17-15-16-11-7-3-4-8-12(11)21-15/h1-2,9-10H,3-8H2,(H,19,20)(H,16,17,18)/p-1/t9-,10+/m0/s1