(2-ethanoyl-4-oxidanylidene-pentyl)-(4-nitrophenyl)carbamic acid

Systemtic Name: (2-ethanoyl-4-oxidanylidene-pentyl)-(4-nitrophenyl)carbamic acid Openeye Name: (2-acetyl-4-oxo-pentyl)-(4-nitrophenyl)carbamic acid CAS Name: (2-acetyl-4-oxopentyl)-(4-nitrophenyl)carbamic acid IUPAC Name: (2-acetyl-4-oxopentyl)-(4-nitrophenyl)carbamic acid Traditional Name: (2-acetyl-4-keto-pentyl)-(4-nitrophenyl)carbamic acid Formula: C14H16N2O6 MolecularWeight: 308.28664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O6/c1-9(17)7-11(10(2)18)8-15(14(19)20)12-3-5-13(6-4-12)16(21)22/h3-6,11H,7-8H2,1-2H3,(H,19,20)