(7-azanyl-6-methyl-heptyl)-[2-cyano-5-(trifluoromethyl)phenyl]carbamic acid

Systemtic Name: (7-azanyl-6-methyl-heptyl)-[2-cyano-5-(trifluoromethyl)phenyl]carbamic acid Openeye Name: (7-amino-6-methyl-heptyl)-[2-cyano-5-(trifluoromethyl)phenyl]carbamic acid CAS Name: (7-amino-6-methylheptyl)-[2-cyano-5-(trifluoromethyl)phenyl]carbamic acid IUPAC Name: (7-amino-6-methylheptyl)-[2-cyano-5-(trifluoromethyl)phenyl]carbamic acid Traditional Name: (7-amino-6-methyl-heptyl)-[2-cyano-5-(trifluoromethyl)phenyl]carbamic acid Formula: C17H22F3N3O2 MolecularWeight: 357.37069

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCN(C1=C(C=CC(=C1)C(F)(F)F)C#N)C(=O)O)CN

Isomeric SMILES

CC(CCCCCN(C1=C(C=CC(=C1)C(F)(F)F)C#N)C(=O)O)CN

InChI

InChI=1S/C17H22F3N3O2/c1-12(10-21)5-3-2-4-8-23(16(24)25)15-9-14(17(18,19)20)7-6-13(15)11-22/h6-7,9,12H,2-5,8,10,21H2,1H3,(H,24,25)