4-chloranyl-3,6-bis(oxidanylidene)-5-(3-phenylpropylamino)cyclohexa-1,4-diene-1,2-dicarbonitrile

Systemtic Name: 4-chloranyl-3,6-bis(oxidanylidene)-5-(3-phenylpropylamino)cyclohexa-1,4-diene-1,2-dicarbonitrile Openeye Name: 4-chloro-3,6-dioxo-5-(3-phenylpropylamino)cyclohexa-1,4-diene-1,2-dicarbonitrile CAS Name: 4-chloro-3,6-dioxo-5-(3-phenylpropylamino)cyclohexa-1,4-diene-1,2-dicarbonitrile IUPAC Name: 4-chloro-3,6-dioxo-5-(3-phenylpropylamino)cyclohexa-1,4-diene-1,2-dicarbonitrile Traditional Name: 4-chloro-3,6-diketo-5-(3-phenylpropylamino)cyclohexa-1,4-diene-1,2-dicarbonitrile Formula: C17H12ClN3O2 MolecularWeight: 325.74908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC2=C(C(=O)C(=C(C2=O)C#N)C#N)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCCNC2=C(C(=O)C(=C(C2=O)C#N)C#N)Cl

InChI

InChI=1S/C17H12ClN3O2/c18-14-15(17(23)13(10-20)12(9-19)16(14)22)21-8-4-7-11-5-2-1-3-6-11/h1-3,5-6,21H,4,7-8H2