N-[2-(aminomethyl)phenyl]-3-pyrazol-1-yl-propanamide

Systemtic Name: N-[2-(aminomethyl)phenyl]-3-pyrazol-1-yl-propanamide Openeye Name: N-[2-(aminomethyl)phenyl]-3-pyrazol-1-yl-propanamide CAS Name: N-[2-(aminomethyl)phenyl]-3-(1-pyrazolyl)propanamide IUPAC Name: N-[2-(aminomethyl)phenyl]-3-pyrazol-1-ylpropanamide Traditional Name: N-[2-(aminomethyl)phenyl]-3-pyrazol-1-yl-propionamide Formula: C13H16N4O MolecularWeight: 244.29234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN)NC(=O)CCN2C=CC=N2

Isomeric SMILES

C1=CC=C(C(=C1)CN)NC(=O)CCN2C=CC=N2

InChI

InChI=1S/C13H16N4O/c14-10-11-4-1-2-5-12(11)16-13(18)6-9-17-8-3-7-15-17/h1-5,7-8H,6,9-10,14H2,(H,16,18)