3-[(E)-(6-chloranyl-5-nitro-2-oxidanylidene-1H-indol-3-ylidene)methyl]benzenecarbonitrile

Systemtic Name: 3-[(E)-(6-chloranyl-5-nitro-2-oxidanylidene-1H-indol-3-ylidene)methyl]benzenecarbonitrile Openeye Name: 3-[(E)-(6-chloro-5-nitro-2-oxo-indolin-3-ylidene)methyl]benzonitrile CAS Name: 3-[(E)-(6-chloro-5-nitro-2-oxo-1H-indol-3-ylidene)methyl]benzonitrile IUPAC Name: 3-[(E)-(6-chloro-5-nitro-2-oxo-1H-indol-3-ylidene)methyl]benzonitrile Traditional Name: 3-[(E)-(6-chloro-2-keto-5-nitro-indolin-3-ylidene)methyl]benzonitrile Formula: C16H8ClN3O3 MolecularWeight: 325.70602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C=C2C3=CC(=C(C=C3NC2=O)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)/C=C/2\C3=CC(=C(C=C3NC2=O)Cl)[N+](=O)[O-])C#N

InChI

InChI=1S/C16H8ClN3O3/c17-13-7-14-11(6-15(13)20(22)23)12(16(21)19-14)5-9-2-1-3-10(4-9)8-18/h1-7H,(H,19,21)/b12-5+