3-[[(phenylmethyl)amino]methyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-[[(phenylmethyl)amino]methyl]-1H-indole-2-carboxylic acid Openeye Name: 3-[(benzylamino)methyl]-1H-indole-2-carboxylic acid CAS Name: 3-[[(phenylmethyl)amino]methyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-[(benzylamino)methyl]-1H-indole-2-carboxylic acid Traditional Name: 3-[(benzylamino)methyl]-1H-indole-2-carboxylic acid Formula: C17H16N2O2 MolecularWeight: 280.32114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCC2=C(NC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNCC2=C(NC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C17H16N2O2/c20-17(21)16-14(13-8-4-5-9-15(13)19-16)11-18-10-12-6-2-1-3-7-12/h1-9,18-19H,10-11H2,(H,20,21)