N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-(2,5-dimethyl-1H-pyrrol-3-yl)prop-2-enamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-(2,5-dimethyl-1H-pyrrol-3-yl)prop-2-enamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-(2,5-dimethyl-1H-pyrrol-3-yl)prop-2-enamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-(2,5-dimethyl-1H-pyrrol-3-yl)-2-propenamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-(2,5-dimethyl-1H-pyrrol-3-yl)prop-2-enamide Traditional Name: 2-cyano-3-(2,5-dimethyl-1H-pyrrol-3-yl)-N-piperonyl-acrylamide Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C)C=C(C#N)C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC(=C(N1)C)C=C(C#N)C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H17N3O3/c1-11-5-14(12(2)21-11)7-15(8-19)18(22)20-9-13-3-4-16-17(6-13)24-10-23-16/h3-7,21H,9-10H2,1-2H3,(H,20,22)