N-[3-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide

Systemtic Name: N-[3-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide Openeye Name: N-[3-(2-amino-2-oxo-ethoxy)phenyl]-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide CAS Name: N-[3-(2-amino-2-oxoethoxy)phenyl]-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide IUPAC Name: N-[3-(2-amino-2-oxoethoxy)phenyl]-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide Traditional Name: N-[3-(2-amino-2-keto-ethoxy)phenyl]-4-keto-4-(3-phenyl-2-pyrazolin-1-yl)butyramide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC=CC=C2)C(=O)CCC(=O)NC3=CC(=CC=C3)OCC(=O)N

Isomeric SMILES

C1CN(N=C1C2=CC=CC=C2)C(=O)CCC(=O)NC3=CC(=CC=C3)OCC(=O)N

InChI

InChI=1S/C21H22N4O4/c22-19(26)14-29-17-8-4-7-16(13-17)23-20(27)9-10-21(28)25-12-11-18(24-25)15-5-2-1-3-6-15/h1-8,13H,9-12,14H2,(H2,22,26)(H,23,27)