(1R,3R)-3-(1,3-benzothiazol-2-ylcarbamoyl)-1,2,2-trimethyl-cyclopentane-1-carboxylate

Systemtic Name: (1R,3R)-3-(1,3-benzothiazol-2-ylcarbamoyl)-1,2,2-trimethyl-cyclopentane-1-carboxylate Openeye Name: (1R,3R)-3-(1,3-benzothiazol-2-ylcarbamoyl)-1,2,2-trimethyl-cyclopentanecarboxylate CAS Name: (1R,3R)-3-[(1,3-benzothiazol-2-ylamino)-oxomethyl]-1,2,2-trimethyl-1-cyclopentanecarboxylate IUPAC Name: (1R,3R)-3-(1,3-benzothiazol-2-ylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylate Traditional Name: (1R,3R)-3-(1,3-benzothiazol-2-ylcarbamoyl)-1,2,2-trimethyl-cyclopentanecarboxylate Formula: C17H19N2O3S- MolecularWeight: 331.40936

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC1(C)C(=O)[O-])C(=O)NC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

C[C@]1(CC[C@H](C1(C)C)C(=O)NC2=NC3=CC=CC=C3S2)C(=O)[O-]

InChI

InChI=1S/C17H20N2O3S/c1-16(2)10(8-9-17(16,3)14(21)22)13(20)19-15-18-11-6-4-5-7-12(11)23-15/h4-7,10H,8-9H2,1-3H3,(H,21,22)(H,18,19,20)/p-1/t10-,17-/m0/s1