[4-(phenylcarbamoyl)phenyl]methyl 6-oxidanylidene-1-propyl-pyridazine-3-carboxylate

Systemtic Name: [4-(phenylcarbamoyl)phenyl]methyl 6-oxidanylidene-1-propyl-pyridazine-3-carboxylate Openeye Name: [4-(phenylcarbamoyl)phenyl]methyl 6-oxo-1-propyl-pyridazine-3-carboxylate CAS Name: 6-oxo-1-propyl-3-pyridazinecarboxylic acid [4-[anilino(oxo)methyl]phenyl]methyl ester IUPAC Name: [4-(phenylcarbamoyl)phenyl]methyl 6-oxo-1-propylpyridazine-3-carboxylate Traditional Name: 6-keto-1-propyl-pyridazine-3-carboxylic acid [4-(phenylcarbamoyl)benzyl] ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)OCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)OCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H21N3O4/c1-2-14-25-20(26)13-12-19(24-25)22(28)29-15-16-8-10-17(11-9-16)21(27)23-18-6-4-3-5-7-18/h3-13H,2,14-15H2,1H3,(H,23,27)