2-[[3-chloranyl-4-[(S)-cyano(phenyl)methyl]phenyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[[3-chloranyl-4-[(S)-cyano(phenyl)methyl]phenyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-[[3-chloro-4-[(S)-cyano(phenyl)methyl]phenyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-[[3-chloro-4-[(S)-cyano(phenyl)methyl]phenyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[[3-chloro-4-[(S)-cyano(phenyl)methyl]phenyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-[[3-chloro-4-[(S)-cyano(phenyl)methyl]phenyl]iminomethyl]-4-nitro-phenolate Formula: C21H13ClN3O3- MolecularWeight: 390.79922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)C2=C(C=C(C=C2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C#N)C2=C(C=C(C=C2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-])Cl

InChI

InChI=1S/C21H14ClN3O3/c22-20-11-16(24-13-15-10-17(25(27)28)7-9-21(15)26)6-8-18(20)19(12-23)14-4-2-1-3-5-14/h1-11,13,19,26H/p-1/t19-/m0/s1