2-nitro-4-[(Z)-[[(4S)-4-oxidanyl-4-phenyl-butanoyl]hydrazinylidene]methyl]phenolate

Systemtic Name: 2-nitro-4-[(Z)-[[(4S)-4-oxidanyl-4-phenyl-butanoyl]hydrazinylidene]methyl]phenolate Openeye Name: 4-[(Z)-[[(4S)-4-hydroxy-4-phenyl-butanoyl]hydrazono]methyl]-2-nitro-phenolate CAS Name: 4-[(Z)-[[(4S)-4-hydroxy-1-oxo-4-phenylbutyl]hydrazinylidene]methyl]-2-nitrophenolate IUPAC Name: 4-[(Z)-[[(4S)-4-hydroxy-4-phenylbutanoyl]hydrazinylidene]methyl]-2-nitrophenolate Traditional Name: 4-[(Z)-[[(4S)-4-hydroxy-4-phenyl-butanoyl]hydrazono]methyl]-2-nitro-phenolate Formula: C17H16N3O5- MolecularWeight: 342.32604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCC(=O)NN=CC2=CC(=C(C=C2)[O-])[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)[C@H](CCC(=O)N/N=C\C2=CC(=C(C=C2)[O-])[N+](=O)[O-])O

InChI

InChI=1S/C17H17N3O5/c21-15(13-4-2-1-3-5-13)8-9-17(23)19-18-11-12-6-7-16(22)14(10-12)20(24)25/h1-7,10-11,15,21-22H,8-9H2,(H,19,23)/p-1/b18-11-/t15-/m0/s1