2-(dimethylamino)-N-(3,4-dimethyl-1,2-oxazol-5-yl)ethanamide; 2,4,6-trinitrophenolate

Systemtic Name: 2-(dimethylamino)-N-(3,4-dimethyl-1,2-oxazol-5-yl)ethanamide; 2,4,6-trinitrophenolate Openeye Name: 2-(dimethylamino)-N-(3,4-dimethylisoxazol-5-yl)acetamide; 2,4,6-trinitrophenolate CAS Name: 2-(dimethylamino)-N-(3,4-dimethyl-5-isoxazolyl)acetamide; 2,4,6-trinitrophenolate IUPAC Name: 2-(dimethylamino)-N-(3,4-dimethyl-1,2-oxazol-5-yl)acetamide; 2,4,6-trinitrophenolate Traditional Name: 2-(dimethylamino)-N-(3,4-dimethylisoxazol-5-yl)acetamide picrate Formula: C15H17N6O9- MolecularWeight: 425.33028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1C)NC(=O)CN(C)C.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(ON=C1C)NC(=O)CN(C)C.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H15N3O2.C6H3N3O7/c1-6-7(2)11-14-9(6)10-8(13)5-12(3)4;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h5H2,1-4H3,(H,10,13);1-2,10H/p-1