2-[(Z)-[[(2S)-2-(3-methyl-4-nitro-phenoxy)propanoyl]hydrazinylidene]methyl]benzoate

Systemtic Name: 2-[(Z)-[[(2S)-2-(3-methyl-4-nitro-phenoxy)propanoyl]hydrazinylidene]methyl]benzoate Openeye Name: 2-[(Z)-[[(2S)-2-(3-methyl-4-nitro-phenoxy)propanoyl]hydrazono]methyl]benzoate CAS Name: 2-[(Z)-[[(2S)-2-(3-methyl-4-nitrophenoxy)-1-oxopropyl]hydrazinylidene]methyl]benzoate IUPAC Name: 2-[(Z)-[[(2S)-2-(3-methyl-4-nitrophenoxy)propanoyl]hydrazinylidene]methyl]benzoate Traditional Name: 2-[(Z)-[[(2S)-2-(3-methyl-4-nitro-phenoxy)propanoyl]hydrazono]methyl]benzoate Formula: C18H16N3O6- MolecularWeight: 370.33614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(C)C(=O)NN=CC2=CC=CC=C2C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)O[C@@H](C)C(=O)N/N=C\C2=CC=CC=C2C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O6/c1-11-9-14(7-8-16(11)21(25)26)27-12(2)17(22)20-19-10-13-5-3-4-6-15(13)18(23)24/h3-10,12H,1-2H3,(H,20,22)(H,23,24)/p-1/b19-10-/t12-/m0/s1