6-(3,4-dichlorophenyl)-6-(1H-isoindol-5-ylamino)cyclohexa-1,3-diene-1-carbonitrile

Systemtic Name: 6-(3,4-dichlorophenyl)-6-(1H-isoindol-5-ylamino)cyclohexa-1,3-diene-1-carbonitrile Openeye Name: 6-(3,4-dichlorophenyl)-6-(1H-isoindol-5-ylamino)cyclohexa-1,3-diene-1-carbonitrile CAS Name: 6-(3,4-dichlorophenyl)-6-(1H-isoindol-5-ylamino)-1-cyclohexa-1,3-dienecarbonitrile IUPAC Name: 6-(3,4-dichlorophenyl)-6-(1H-isoindol-5-ylamino)cyclohexa-1,3-diene-1-carbonitrile Traditional Name: 6-(3,4-dichlorophenyl)-6-(1H-isoindol-5-ylamino)cyclohexa-1,3-diene-1-carbonitrile Formula: C21H15Cl2N3 MolecularWeight: 380.2699

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=C(C1(C2=CC(=C(C=C2)Cl)Cl)NC3=CC4=C(CN=C4)C=C3)C#N

Isomeric SMILES

C1C=CC=C(C1(C2=CC(=C(C=C2)Cl)Cl)NC3=CC4=C(CN=C4)C=C3)C#N

InChI

InChI=1S/C21H15Cl2N3/c22-19-7-5-16(10-20(19)23)21(8-2-1-3-17(21)11-24)26-18-6-4-14-12-25-13-15(14)9-18/h1-7,9-10,13,26H,8,12H2