3-azanyl-2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-4-methanoyl-cyclopent-3-ene-1,1,2-tricarbonitrile

Systemtic Name: 3-azanyl-2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-4-methanoyl-cyclopent-3-ene-1,1,2-tricarbonitrile Openeye Name: 3-amino-2-[2-(4-bromophenyl)-2-oxo-ethyl]-4-formyl-cyclopent-3-ene-1,1,2-tricarbonitrile CAS Name: 3-amino-2-[2-(4-bromophenyl)-2-oxoethyl]-4-formylcyclopent-3-ene-1,1,2-tricarbonitrile IUPAC Name: 3-amino-2-[2-(4-bromophenyl)-2-oxoethyl]-4-formylcyclopent-3-ene-1,1,2-tricarbonitrile Traditional Name: 3-amino-2-[2-(4-bromophenyl)-2-keto-ethyl]-4-formyl-cyclopent-3-ene-1,1,2-tricarbonitrile Formula: C17H11BrN4O2 MolecularWeight: 383.19884

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(C(C1(C#N)C#N)(CC(=O)C2=CC=C(C=C2)Br)C#N)N)C=O

Isomeric SMILES

C1C(=C(C(C1(C#N)C#N)(CC(=O)C2=CC=C(C=C2)Br)C#N)N)C=O

InChI

InChI=1S/C17H11BrN4O2/c18-13-3-1-11(2-4-13)14(24)6-17(10-21)15(22)12(7-23)5-16(17,8-19)9-20/h1-4,7H,5-6,22H2