6-[(3-cyanophenyl)methylamino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[(3-cyanophenyl)methylamino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[(3-cyanophenyl)methylamino]-6-oxo-hexanoic acid CAS Name: 6-[(3-cyanophenyl)methylamino]-6-oxohexanoic acid IUPAC Name: 6-[(3-cyanophenyl)methylamino]-6-oxohexanoic acid Traditional Name: 6-[(3-cyanobenzyl)amino]-6-keto-hexanoic acid Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CNC(=O)CCCCC(=O)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CNC(=O)CCCCC(=O)O)C#N

InChI

InChI=1S/C14H16N2O3/c15-9-11-4-3-5-12(8-11)10-16-13(17)6-1-2-7-14(18)19/h3-5,8H,1-2,6-7,10H2,(H,16,17)(H,18,19)