(2S,3aR)-3,3a,4,5,6,7-hexahydro-2H-indole-2-carboxylic acid

Systemtic Name: (2S,3aR)-3,3a,4,5,6,7-hexahydro-2H-indole-2-carboxylic acid Openeye Name: (2S,3aR)-3,3a,4,5,6,7-hexahydro-2H-indole-2-carboxylic acid CAS Name: (2S,3aR)-3,3a,4,5,6,7-hexahydro-2H-indole-2-carboxylic acid IUPAC Name: (2S,3aR)-3,3a,4,5,6,7-hexahydro-2H-indole-2-carboxylic acid Traditional Name: (2S,3aR)-3,3a,4,5,6,7-hexahydro-2H-indole-2-carboxylic acid Formula: C9H13NO2 MolecularWeight: 167.20502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC(CC2C1)C(=O)O

Isomeric SMILES

C1CCC2=N[C@@H](C[C@H]2C1)C(=O)O

InChI

InChI=1S/C9H13NO2/c11-9(12)8-5-6-3-1-2-4-7(6)10-8/h6,8H,1-5H2,(H,11,12)/t6-,8+/m1/s1