(Z)-3-(1,3-benzodioxol-5-ylmethylamino)-2-cyano-N-(phenylmethyl)but-2-enamide

Systemtic Name: (Z)-3-(1,3-benzodioxol-5-ylmethylamino)-2-cyano-N-(phenylmethyl)but-2-enamide Openeye Name: (Z)-3-(1,3-benzodioxol-5-ylmethylamino)-N-benzyl-2-cyano-but-2-enamide CAS Name: (Z)-3-(1,3-benzodioxol-5-ylmethylamino)-2-cyano-N-(phenylmethyl)-2-butenamide IUPAC Name: (Z)-3-(1,3-benzodioxol-5-ylmethylamino)-N-benzyl-2-cyanobut-2-enamide Traditional Name: (Z)-N-benzyl-2-cyano-3-(piperonylamino)but-2-enamide Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)NCC1=CC=CC=C1)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C/C(=C(\C#N)/C(=O)NCC1=CC=CC=C1)/NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H19N3O3/c1-14(22-12-16-7-8-18-19(9-16)26-13-25-18)17(10-21)20(24)23-11-15-5-3-2-4-6-15/h2-9,22H,11-13H2,1H3,(H,23,24)/b17-14-