4-[[[(2S)-2-[(4-chlorophenyl)carbonylamino]-3-methyl-butanoyl]hydrazinylidene]methyl]-2-nitro-phenolate

Systemtic Name: 4-[[[(2S)-2-[(4-chlorophenyl)carbonylamino]-3-methyl-butanoyl]hydrazinylidene]methyl]-2-nitro-phenolate Openeye Name: 4-[[[(2S)-2-[(4-chlorobenzoyl)amino]-3-methyl-butanoyl]hydrazono]methyl]-2-nitro-phenolate CAS Name: 4-[[[(2S)-2-[[(4-chlorophenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]hydrazinylidene]methyl]-2-nitrophenolate IUPAC Name: 4-[[[(2S)-2-[(4-chlorobenzoyl)amino]-3-methylbutanoyl]hydrazinylidene]methyl]-2-nitrophenolate Traditional Name: 4-[[[(2S)-2-[(4-chlorobenzoyl)amino]-3-methyl-butanoyl]hydrazono]methyl]-2-nitro-phenolate Formula: C19H18ClN4O5- MolecularWeight: 417.82302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NN=CC1=CC(=C(C=C1)[O-])[N+](=O)[O-])NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)NN=CC1=CC(=C(C=C1)[O-])[N+](=O)[O-])NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H19ClN4O5/c1-11(2)17(22-18(26)13-4-6-14(20)7-5-13)19(27)23-21-10-12-3-8-16(25)15(9-12)24(28)29/h3-11,17,25H,1-2H3,(H,22,26)(H,23,27)/p-1/t17-/m0/s1