3-bromanyl-2-[(3-oxidanylidene-4-prop-2-enyl-cyclopenten-1-yl)amino]benzenecarbonitrile

Systemtic Name: 3-bromanyl-2-[(3-oxidanylidene-4-prop-2-enyl-cyclopenten-1-yl)amino]benzenecarbonitrile Openeye Name: 2-[(4-allyl-3-oxo-cyclopenten-1-yl)amino]-3-bromo-benzonitrile CAS Name: 3-bromo-2-[(3-oxo-4-prop-2-enyl-1-cyclopentenyl)amino]benzonitrile IUPAC Name: 3-bromo-2-[(3-oxo-4-prop-2-enylcyclopenten-1-yl)amino]benzonitrile Traditional Name: 2-[(4-allyl-3-keto-cyclopenten-1-yl)amino]-3-bromo-benzonitrile Formula: C15H13BrN2O MolecularWeight: 317.18052

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1CC(=CC1=O)NC2=C(C=CC=C2Br)C#N

Isomeric SMILES

C=CCC1CC(=CC1=O)NC2=C(C=CC=C2Br)C#N

InChI

InChI=1S/C15H13BrN2O/c1-2-4-10-7-12(8-14(10)19)18-15-11(9-17)5-3-6-13(15)16/h2-3,5-6,8,10,18H,1,4,7H2