N-[3-(aminomethyl)phenyl]-3-[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]propanamide

Systemtic Name: N-[3-(aminomethyl)phenyl]-3-[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]propanamide Openeye Name: N-[3-(aminomethyl)phenyl]-3-(3,6-dioxo-1H-pyridazin-2-yl)propanamide CAS Name: N-[3-(aminomethyl)phenyl]-3-(3,6-dioxo-1H-pyridazin-2-yl)propanamide IUPAC Name: N-[3-(aminomethyl)phenyl]-3-(3,6-dioxo-1H-pyridazin-2-yl)propanamide Traditional Name: N-[3-(aminomethyl)phenyl]-3-(3,6-diketo-1H-pyridazin-2-yl)propionamide Formula: C14H16N4O3 MolecularWeight: 288.30184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N4O3/c15-9-10-2-1-3-11(8-10)16-12(19)6-7-18-14(21)5-4-13(20)17-18/h1-5,8H,6-7,9,15H2,(H,16,19)(H,17,20)