4-oxidanylidene-3-propyl-2-pyren-1-yl-nonadecanal

Systemtic Name: 4-oxidanylidene-3-propyl-2-pyren-1-yl-nonadecanal Openeye Name: 4-oxo-3-propyl-2-pyren-1-yl-nonadecanal CAS Name: 4-oxo-3-propyl-2-(1-pyrenyl)nonadecanal IUPAC Name: 4-oxo-3-propyl-2-pyren-1-ylnonadecanal Traditional Name: 4-keto-3-propyl-2-pyren-1-yl-nonadecanal Formula: C38H50O2 MolecularWeight: 538.8024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(CCC)C(C=O)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(CCC)C(C=O)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

InChI

InChI=1S/C38H50O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-21-36(40)33(18-4-2)35(28-39)32-26-24-31-23-22-29-19-17-20-30-25-27-34(32)38(31)37(29)30/h17,19-20,22-28,33,35H,3-16,18,21H2,1-2H3