2-methyl-4-[5-[2-(5-nitronaphthalen-1-yl)ethynyl]naphthalen-1-yl]but-3-yn-2-ol

Systemtic Name: 2-methyl-4-[5-[2-(5-nitronaphthalen-1-yl)ethynyl]naphthalen-1-yl]but-3-yn-2-ol Openeye Name: 2-methyl-4-[5-[2-(5-nitro-1-naphthyl)ethynyl]-1-naphthyl]but-3-yn-2-ol CAS Name: 2-methyl-4-[5-[2-(5-nitro-1-naphthalenyl)ethynyl]-1-naphthalenyl]-3-butyn-2-ol IUPAC Name: 2-methyl-4-[5-[2-(5-nitronaphthalen-1-yl)ethynyl]naphthalen-1-yl]but-3-yn-2-ol Traditional Name: 2-methyl-4-[5-[2-(5-nitro-1-naphthyl)ethynyl]-1-naphthyl]but-3-yn-2-ol Formula: C27H19NO3 MolecularWeight: 405.44466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC=CC2=C(C=CC=C21)C#CC3=C4C=CC=C(C4=CC=C3)[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C#CC1=CC=CC2=C(C=CC=C21)C#CC3=C4C=CC=C(C4=CC=C3)[N+](=O)[O-])O

InChI

InChI=1S/C27H19NO3/c1-27(2,29)18-17-21-9-4-10-22-19(7-3-11-23(21)22)15-16-20-8-5-13-25-24(20)12-6-14-26(25)28(30)31/h3-14,29H,1-2H3