3-methyl-1-[4-[(6-octoxynaphthalen-1-yl)oxymethyl]phenyl]pentan-1-one

Systemtic Name: 3-methyl-1-[4-[(6-octoxynaphthalen-1-yl)oxymethyl]phenyl]pentan-1-one Openeye Name: 3-methyl-1-[4-[(6-octoxy-1-naphthyl)oxymethyl]phenyl]pentan-1-one CAS Name: 3-methyl-1-[4-[(6-octoxy-1-naphthalenyl)oxymethyl]phenyl]-1-pentanone IUPAC Name: 3-methyl-1-[4-[(6-octoxynaphthalen-1-yl)oxymethyl]phenyl]pentan-1-one Traditional Name: 3-methyl-1-[4-[(6-octoxy-1-naphthoxy)methyl]phenyl]pentan-1-one Formula: C31H40O3 MolecularWeight: 460.6475

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC2=C(C=C1)C(=CC=C2)OCC3=CC=C(C=C3)C(=O)CC(C)CC

Isomeric SMILES

CCCCCCCCOC1=CC2=C(C=C1)C(=CC=C2)OCC3=CC=C(C=C3)C(=O)CC(C)CC

InChI

InChI=1S/C31H40O3/c1-4-6-7-8-9-10-20-33-28-18-19-29-27(22-28)12-11-13-31(29)34-23-25-14-16-26(17-15-25)30(32)21-24(3)5-2/h11-19,22,24H,4-10,20-21,23H2,1-3H3