(E)-2-(azetidin-1-ylcarbonyl)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(azetidin-1-ylcarbonyl)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enenitrile Openeye Name: (E)-2-(azetidine-1-carbonyl)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enenitrile CAS Name: (E)-2-[1-azetidinyl(oxo)methyl]-3-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-2-propenenitrile IUPAC Name: (E)-2-(azetidine-1-carbonyl)-3-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)prop-2-enenitrile Traditional Name: (E)-2-(azetidine-1-carbonyl)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)acrylonitrile Formula: C16H19N3O MolecularWeight: 269.34156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C=C(C#N)C(=O)N3CCC3

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)/C=C(\C#N)/C(=O)N3CCC3

InChI

InChI=1S/C16H19N3O/c1-11-8-13(12(2)19(11)15-4-5-15)9-14(10-17)16(20)18-6-3-7-18/h8-9,15H,3-7H2,1-2H3/b14-9+