2-heptyl-1-(prop-2-enylamino)cycloheptane-1-carboxylic acid

Systemtic Name: 2-heptyl-1-(prop-2-enylamino)cycloheptane-1-carboxylic acid Openeye Name: 1-(allylamino)-2-heptyl-cycloheptanecarboxylic acid CAS Name: 2-heptyl-1-(prop-2-enylamino)-1-cycloheptanecarboxylic acid IUPAC Name: 2-heptyl-1-(prop-2-enylamino)cycloheptane-1-carboxylic acid Traditional Name: 1-(allylamino)-2-heptyl-cycloheptanecarboxylic acid Formula: C18H33NO2 MolecularWeight: 295.46012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCCCCC1(C(=O)O)NCC=C

Isomeric SMILES

CCCCCCCC1CCCCCC1(C(=O)O)NCC=C

InChI

InChI=1S/C18H33NO2/c1-3-5-6-7-9-12-16-13-10-8-11-14-18(16,17(20)21)19-15-4-2/h4,16,19H,2-3,5-15H2,1H3,(H,20,21)