3-[(4-cyanophenyl)carbonylamino]-2,2-dimethyl-tridecanoic acid

Systemtic Name: 3-[(4-cyanophenyl)carbonylamino]-2,2-dimethyl-tridecanoic acid Openeye Name: 3-[(4-cyanobenzoyl)amino]-2,2-dimethyl-tridecanoic acid CAS Name: 3-[[(4-cyanophenyl)-oxomethyl]amino]-2,2-dimethyltridecanoic acid IUPAC Name: 3-[(4-cyanobenzoyl)amino]-2,2-dimethyltridecanoic acid Traditional Name: 3-[(4-cyanobenzoyl)amino]-2,2-dimethyl-tridecanoic acid Formula: C23H34N2O3 MolecularWeight: 386.52766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C(C)(C)C(=O)O)NC(=O)C1=CC=C(C=C1)C#N

Isomeric SMILES

CCCCCCCCCCC(C(C)(C)C(=O)O)NC(=O)C1=CC=C(C=C1)C#N

InChI

InChI=1S/C23H34N2O3/c1-4-5-6-7-8-9-10-11-12-20(23(2,3)22(27)28)25-21(26)19-15-13-18(17-24)14-16-19/h13-16,20H,4-12H2,1-3H3,(H,25,26)(H,27,28)