1-phenyl-3-(2,3,5,6-tetramethyl-4-nitro-phenyl)prop-2-yn-1-one

Systemtic Name: 1-phenyl-3-(2,3,5,6-tetramethyl-4-nitro-phenyl)prop-2-yn-1-one Openeye Name: 1-phenyl-3-(2,3,5,6-tetramethyl-4-nitro-phenyl)prop-2-yn-1-one CAS Name: 1-phenyl-3-(2,3,5,6-tetramethyl-4-nitrophenyl)-2-propyn-1-one IUPAC Name: 1-phenyl-3-(2,3,5,6-tetramethyl-4-nitrophenyl)prop-2-yn-1-one Traditional Name: 1-phenyl-3-(2,3,5,6-tetramethyl-4-nitro-phenyl)prop-2-yn-1-one Formula: C19H17NO3 MolecularWeight: 307.34318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C#CC(=O)C2=CC=CC=C2)C)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=C(C(=C1C#CC(=O)C2=CC=CC=C2)C)C)[N+](=O)[O-])C

InChI

InChI=1S/C19H17NO3/c1-12-14(3)19(20(22)23)15(4)13(2)17(12)10-11-18(21)16-8-6-5-7-9-16/h5-9H,1-4H3