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

Systemtic Name: 3-azanyl-2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-4-(hydroxymethyl)cyclopent-3-ene-1,1,2-tricarbonitrile Openeye Name: 3-amino-2-[2-(4-bromophenyl)-2-oxo-ethyl]-4-(hydroxymethyl)cyclopent-3-ene-1,1,2-tricarbonitrile CAS Name: 3-amino-2-[2-(4-bromophenyl)-2-oxoethyl]-4-(hydroxymethyl)cyclopent-3-ene-1,1,2-tricarbonitrile IUPAC Name: 3-amino-2-[2-(4-bromophenyl)-2-oxoethyl]-4-(hydroxymethyl)cyclopent-3-ene-1,1,2-tricarbonitrile Traditional Name: 3-amino-2-[2-(4-bromophenyl)-2-keto-ethyl]-4-methylol-cyclopent-3-ene-1,1,2-tricarbonitrile Formula: C17H13BrN4O2 MolecularWeight: 385.21472

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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)CO

Isomeric SMILES

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

InChI

InChI=1S/C17H13BrN4O2/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/h1-4,23H,5-7,22H2