5-[(3-nitrophenyl)amino]-5-oxidanylidene-2-propyl-pentanoic acid

Systemtic Name: 5-[(3-nitrophenyl)amino]-5-oxidanylidene-2-propyl-pentanoic acid Openeye Name: 5-(3-nitroanilino)-5-oxo-2-propyl-pentanoic acid CAS Name: 5-(3-nitroanilino)-5-oxo-2-propylpentanoic acid IUPAC Name: 5-(3-nitroanilino)-5-oxo-2-propylpentanoic acid Traditional Name: 5-keto-5-(3-nitroanilino)-2-propyl-valeric acid Formula: C14H18N2O5 MolecularWeight: 294.30312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC(=O)NC1=CC(=CC=C1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCCC(CCC(=O)NC1=CC(=CC=C1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H18N2O5/c1-2-4-10(14(18)19)7-8-13(17)15-11-5-3-6-12(9-11)16(20)21/h3,5-6,9-10H,2,4,7-8H2,1H3,(H,15,17)(H,18,19)