3-pyren-4-ylpropanal

Systemtic Name: 3-pyren-4-ylpropanal Openeye Name: 3-pyren-4-ylpropanal CAS Name: 3-(4-pyrenyl)propanal IUPAC Name: 3-pyren-4-ylpropanal Traditional Name: 3-pyren-4-ylpropionaldehyde Formula: C19H14O MolecularWeight: 258.31386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=C(C4=CC=CC(=C43)C=C2)CCC=O

Isomeric SMILES

C1=CC2=C3C(=C1)C=C(C4=CC=CC(=C43)C=C2)CCC=O

InChI

InChI=1S/C19H14O/c20-11-3-7-15-12-16-6-1-4-13-9-10-14-5-2-8-17(15)19(14)18(13)16/h1-2,4-6,8-12H,3,7H2