N-(1,3-benzodioxol-5-ylmethyl)-N'-(5-methyl-2,4-diphenyl-pyrazol-3-yl)butanediamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-(5-methyl-2,4-diphenyl-pyrazol-3-yl)butanediamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-(5-methyl-2,4-diphenyl-pyrazol-3-yl)butanediamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-(5-methyl-2,4-diphenyl-3-pyrazolyl)butanediamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N'-(5-methyl-2,4-diphenylpyrazol-3-yl)butanediamide Traditional Name: N'-(5-methyl-2,4-diphenyl-pyrazol-3-yl)-N-piperonyl-succinamide Formula: C28H26N4O4 MolecularWeight: 482.53044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2=CC=CC=C2)NC(=O)CCC(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C2=CC=CC=C2)NC(=O)CCC(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C28H26N4O4/c1-19-27(21-8-4-2-5-9-21)28(32(31-19)22-10-6-3-7-11-22)30-26(34)15-14-25(33)29-17-20-12-13-23-24(16-20)36-18-35-23/h2-13,16H,14-15,17-18H2,1H3,(H,29,33)(H,30,34)