2-(12-azanyldodecyl)bicyclo[4.1.0]hepta-1,3,5-triene-5-carboxylic acid

Systemtic Name: 2-(12-azanyldodecyl)bicyclo[4.1.0]hepta-1,3,5-triene-5-carboxylic acid Openeye Name: 2-(12-aminododecyl)bicyclo[4.1.0]hepta-1,3,5-triene-5-carboxylic acid CAS Name: 2-(12-aminododecyl)-5-bicyclo[4.1.0]hepta-1,3,5-trienecarboxylic acid IUPAC Name: 2-(12-aminododecyl)bicyclo[4.1.0]hepta-1,3,5-triene-5-carboxylic acid Traditional Name: 2-(12-aminododecyl)bicyclo[4.1.0]hepta-1,3,5-triene-5-carboxylic acid Formula: C20H31NO2 MolecularWeight: 317.46564

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C21)C(=O)O)CCCCCCCCCCCCN

Isomeric SMILES

C1C2=C(C=CC(=C21)C(=O)O)CCCCCCCCCCCCN

InChI

InChI=1S/C20H31NO2/c21-14-10-8-6-4-2-1-3-5-7-9-11-16-12-13-17(20(22)23)19-15-18(16)19/h12-13H,1-11,14-15,21H2,(H,22,23)