4-azanyl-1-(phenylmethyl)azepane-4-carboxylic acid

Systemtic Name: 4-azanyl-1-(phenylmethyl)azepane-4-carboxylic acid Openeye Name: 4-amino-1-benzyl-azepane-4-carboxylic acid CAS Name: 4-amino-1-(phenylmethyl)-4-azepanecarboxylic acid IUPAC Name: 4-amino-1-benzylazepane-4-carboxylic acid Traditional Name: 4-amino-1-benzyl-azepane-4-carboxylic acid Formula: C14H20N2O2 MolecularWeight: 248.3208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCN(C1)CC2=CC=CC=C2)(C(=O)O)N

Isomeric SMILES

C1CC(CCN(C1)CC2=CC=CC=C2)(C(=O)O)N

InChI

InChI=1S/C14H20N2O2/c15-14(13(17)18)7-4-9-16(10-8-14)11-12-5-2-1-3-6-12/h1-3,5-6H,4,7-11,15H2,(H,17,18)