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

Systemtic Name: 2-(dimethylamino)-N-(3,4-dimethyl-1,2-oxazol-5-yl)propanamide; 2,4,6-trinitrophenolate Openeye Name: 2-(dimethylamino)-N-(3,4-dimethylisoxazol-5-yl)propanamide; 2,4,6-trinitrophenolate CAS Name: 2-(dimethylamino)-N-(3,4-dimethyl-5-isoxazolyl)propanamide; 2,4,6-trinitrophenolate IUPAC Name: 2-(dimethylamino)-N-(3,4-dimethyl-1,2-oxazol-5-yl)propanamide; 2,4,6-trinitrophenolate Traditional Name: 2-(dimethylamino)-N-(3,4-dimethylisoxazol-5-yl)propionamide picrate Formula: C16H19N6O9- MolecularWeight: 439.35686

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C10H17N3O2.C6H3N3O7/c1-6-7(2)12-15-10(6)11-9(14)8(3)13(4)5;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h8H,1-5H3,(H,11,14);1-2,10H/p-1