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

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 1-butyl-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 1-butyl-6-oxo-pyridazine-3-carboxylate CAS Name: 1-butyl-6-oxo-3-pyridazinecarboxylic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 1-butyl-6-oxopyridazine-3-carboxylate Traditional Name: 1-butyl-6-keto-pyridazine-3-carboxylic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C=CC(=N1)C(=O)OCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCCCN1C(=O)C=CC(=N1)C(=O)OCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C18H21N3O4/c1-2-3-11-21-17(23)10-9-15(20-21)18(24)25-13-16(22)19-12-14-7-5-4-6-8-14/h4-10H,2-3,11-13H2,1H3,(H,19,22)