N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-2-(4-tert-butylphenoxy)ethanamide

Systemtic Name: N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-2-(4-tert-butylphenoxy)ethanamide Openeye Name: N-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]-2-(4-tert-butylphenoxy)acetamide CAS Name: N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-2-(4-tert-butylphenoxy)acetamide IUPAC Name: N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]-2-(4-tert-butylphenoxy)acetamide Traditional Name: N-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]-2-(4-tert-butylphenoxy)acetamide Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)COC1=CC=C(C=C1)C(C)(C)C)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C/C(=N\NC(=O)COC1=CC=C(C=C1)C(C)(C)C)/CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C23H28N2O4/c1-16(5-6-17-7-12-20-21(13-17)29-15-28-20)24-25-22(26)14-27-19-10-8-18(9-11-19)23(2,3)4/h7-13H,5-6,14-15H2,1-4H3,(H,25,26)/b24-16+