3-methyl-2-[[(2Z)-2-[(2-nitrophenyl)methylidene]-3-oxidanylidene-butanoyl]amino]butanoic acid

Systemtic Name: 3-methyl-2-[[(2Z)-2-[(2-nitrophenyl)methylidene]-3-oxidanylidene-butanoyl]amino]butanoic acid Openeye Name: 3-methyl-2-[[(2Z)-2-[(2-nitrophenyl)methylene]-3-oxo-butanoyl]amino]butanoic acid CAS Name: 3-methyl-2-[[(2Z)-2-[(2-nitrophenyl)methylidene]-1,3-dioxobutyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[[(2Z)-2-[(2-nitrophenyl)methylidene]-3-oxobutanoyl]amino]butanoic acid Traditional Name: 2-[[(Z)-2-acetyl-3-(2-nitrophenyl)acryloyl]amino]-3-methyl-butyric acid Formula: C16H18N2O6 MolecularWeight: 334.32392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O6/c1-9(2)14(16(21)22)17-15(20)12(10(3)19)8-11-6-4-5-7-13(11)18(23)24/h4-9,14H,1-3H3,(H,17,20)(H,21,22)/b12-8-