N-(1,3-benzodioxol-5-ylmethyl)-4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide Traditional Name: 4-keto-4-(3-phenyl-2-pyrazolin-1-yl)-N-piperonyl-butyramide Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC=CC=C2)C(=O)CCC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(N=C1C2=CC=CC=C2)C(=O)CCC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21N3O4/c25-20(22-13-15-6-7-18-19(12-15)28-14-27-18)8-9-21(26)24-11-10-17(23-24)16-4-2-1-3-5-16/h1-7,12H,8-11,13-14H2,(H,22,25)