2-[(2,4-dinitrophenyl)amino]-3-oxidanyl-N-propyl-propanamide

Systemtic Name: 2-[(2,4-dinitrophenyl)amino]-3-oxidanyl-N-propyl-propanamide Openeye Name: 2-(2,4-dinitroanilino)-3-hydroxy-N-propyl-propanamide CAS Name: 2-(2,4-dinitroanilino)-3-hydroxy-N-propylpropanamide IUPAC Name: 2-(2,4-dinitroanilino)-3-hydroxy-N-propylpropanamide Traditional Name: 2-(2,4-dinitroanilino)-3-hydroxy-N-propyl-propionamide Formula: C12H16N4O6 MolecularWeight: 312.27864

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(CO)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)C(CO)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O6/c1-2-5-13-12(18)10(7-17)14-9-4-3-8(15(19)20)6-11(9)16(21)22/h3-4,6,10,14,17H,2,5,7H2,1H3,(H,13,18)