[2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 1-butyl-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 1-butyl-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 1-butyl-6-oxo-pyridazine-3-carboxylate CAS Name: 1-butyl-6-oxo-3-pyridazinecarboxylic acid [2-oxo-2-(3-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 1-butyl-6-oxopyridazine-3-carboxylate Traditional Name: 1-butyl-6-keto-pyridazine-3-carboxylic acid [2-keto-2-(3-phenylpropylamino)ethyl] ester Formula: C20H25N3O4 MolecularWeight: 371.4302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C=CC(=N1)C(=O)OCC(=O)NCCCC2=CC=CC=C2

Isomeric SMILES

CCCCN1C(=O)C=CC(=N1)C(=O)OCC(=O)NCCCC2=CC=CC=C2

InChI

InChI=1S/C20H25N3O4/c1-2-3-14-23-19(25)12-11-17(22-23)20(26)27-15-18(24)21-13-7-10-16-8-5-4-6-9-16/h4-6,8-9,11-12H,2-3,7,10,13-15H2,1H3,(H,21,24)