4-[(Z)-[2-[(4-tert-butylphenyl)carbonylamino]ethanoylhydrazinylidene]methyl]-2-nitro-phenolate

Systemtic Name: 4-[(Z)-[2-[(4-tert-butylphenyl)carbonylamino]ethanoylhydrazinylidene]methyl]-2-nitro-phenolate Openeye Name: 4-[(Z)-[[2-[(4-tert-butylbenzoyl)amino]acetyl]hydrazono]methyl]-2-nitro-phenolate CAS Name: 4-[(Z)-[[2-[[(4-tert-butylphenyl)-oxomethyl]amino]-1-oxoethyl]hydrazinylidene]methyl]-2-nitrophenolate IUPAC Name: 4-[(Z)-[[2-[(4-tert-butylbenzoyl)amino]acetyl]hydrazinylidene]methyl]-2-nitrophenolate Traditional Name: 4-[(Z)-[[2-[(4-tert-butylbenzoyl)amino]acetyl]hydrazono]methyl]-2-nitro-phenolate Formula: C20H21N4O5- MolecularWeight: 397.40454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCC(=O)N/N=C\C2=CC(=C(C=C2)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O5/c1-20(2,3)15-7-5-14(6-8-15)19(27)21-12-18(26)23-22-11-13-4-9-17(25)16(10-13)24(28)29/h4-11,25H,12H2,1-3H3,(H,21,27)(H,23,26)/p-1/b22-11-