2-[[[(4-cyanophenyl)amino]-(cyclononylamino)methylidene]amino]ethanoic acid

Systemtic Name: 2-[[[(4-cyanophenyl)amino]-(cyclononylamino)methylidene]amino]ethanoic acid Openeye Name: 2-[[(4-cyanoanilino)-(cyclononylamino)methylene]amino]acetic acid CAS Name: 2-[[(4-cyanoanilino)-(cyclononylamino)methylidene]amino]acetic acid IUPAC Name: 2-[[(4-cyanoanilino)-(cyclononylamino)methylidene]amino]acetic acid Traditional Name: 2-[[(4-cyanoanilino)-(cyclononylamino)methylene]amino]acetic acid Formula: C19H26N4O2 MolecularWeight: 342.43534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCCC(CCC1)NC(=NCC(=O)O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

C1CCCCC(CCC1)NC(=NCC(=O)O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H26N4O2/c20-13-15-9-11-17(12-10-15)23-19(21-14-18(24)25)22-16-7-5-3-1-2-4-6-8-16/h9-12,16H,1-8,14H2,(H,24,25)(H2,21,22,23)