2-methyl-4-perylen-3-yl-but-3-yn-2-ol

Systemtic Name: 2-methyl-4-perylen-3-yl-but-3-yn-2-ol Openeye Name: 2-methyl-4-perylen-3-yl-but-3-yn-2-ol CAS Name: 2-methyl-4-(3-perylenyl)-3-butyn-2-ol IUPAC Name: 2-methyl-4-perylen-3-ylbut-3-yn-2-ol Traditional Name: 2-methyl-4-perylen-3-yl-but-3-yn-2-ol Formula: C25H18O MolecularWeight: 334.40982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=C2C=CC=C3C2=C(C=C1)C4=CC=CC5=C4C3=CC=C5)O

Isomeric SMILES

CC(C)(C#CC1=C2C=CC=C3C2=C(C=C1)C4=CC=CC5=C4C3=CC=C5)O

InChI

InChI=1S/C25H18O/c1-25(2,26)15-14-16-12-13-22-20-10-4-7-17-6-3-9-19(23(17)20)21-11-5-8-18(16)24(21)22/h3-13,26H,1-2H3