2-(4-methanoyl-2-nitro-phenoxy)-N-prop-2-ynyl-propanamide

Systemtic Name: 2-(4-methanoyl-2-nitro-phenoxy)-N-prop-2-ynyl-propanamide Openeye Name: 2-(4-formyl-2-nitro-phenoxy)-N-prop-2-ynyl-propanamide CAS Name: 2-(4-formyl-2-nitrophenoxy)-N-prop-2-ynylpropanamide IUPAC Name: 2-(4-formyl-2-nitrophenoxy)-N-prop-2-ynylpropanamide Traditional Name: 2-(4-formyl-2-nitro-phenoxy)-N-propargyl-propionamide Formula: C13H12N2O5 MolecularWeight: 276.24478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC#C)OC1=C(C=C(C=C1)C=O)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NCC#C)OC1=C(C=C(C=C1)C=O)[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O5/c1-3-6-14-13(17)9(2)20-12-5-4-10(8-16)7-11(12)15(18)19/h1,4-5,7-9H,6H2,2H3,(H,14,17)