9-[4-(2-hydroxyphenyl)carbonyl-3-oxidanyl-2-propyl-phenoxy]nonanenitrile

Systemtic Name: 9-[4-(2-hydroxyphenyl)carbonyl-3-oxidanyl-2-propyl-phenoxy]nonanenitrile Openeye Name: 9-[3-hydroxy-4-(2-hydroxybenzoyl)-2-propyl-phenoxy]nonanenitrile CAS Name: 9-[3-hydroxy-4-[(2-hydroxyphenyl)-oxomethyl]-2-propylphenoxy]nonanenitrile IUPAC Name: 9-[3-hydroxy-4-(2-hydroxybenzoyl)-2-propylphenoxy]nonanenitrile Traditional Name: 9-(3-hydroxy-2-propyl-4-salicyloyl-phenoxy)pelargononitrile Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C2=CC=CC=C2O)OCCCCCCCCC#N

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C2=CC=CC=C2O)OCCCCCCCCC#N

InChI

InChI=1S/C25H31NO4/c1-2-12-20-23(30-18-11-7-5-3-4-6-10-17-26)16-15-21(25(20)29)24(28)19-13-8-9-14-22(19)27/h8-9,13-16,27,29H,2-7,10-12,18H2,1H3