(E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enamide CAS Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)acrylamide Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C=C(C#N)C(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)/C=C(\C#N)/C(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H23N3O3/c1-13(2)24-14(3)9-16(15(24)4)10-17(12-22)21(25)23-18-5-6-19-20(11-18)27-8-7-26-19/h5-6,9-11,13H,7-8H2,1-4H3,(H,23,25)/b17-10+