2-[1-[(3-phenoxyphenyl)methyl]naphthalen-2-yl]ethanoate; propanenitrile

Systemtic Name: 2-[1-[(3-phenoxyphenyl)methyl]naphthalen-2-yl]ethanoate; propanenitrile Openeye Name: 2-[1-[(3-phenoxyphenyl)methyl]-2-naphthyl]acetate; propanenitrile CAS Name: 2-[1-[(3-phenoxyphenyl)methyl]-2-naphthalenyl]acetate; propanenitrile IUPAC Name: 2-[1-[(3-phenoxyphenyl)methyl]naphthalen-2-yl]acetate; propanenitrile Traditional Name: 2-[1-(3-phenoxybenzyl)-2-naphthyl]acetate; propionitrile Formula: C28H24NO3- MolecularWeight: 422.49506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC#N.C1=CC=C(C=C1)OC2=CC=CC(=C2)CC3=C(C=CC4=CC=CC=C43)CC(=O)[O-]

Isomeric SMILES

CCC#N.C1=CC=C(C=C1)OC2=CC=CC(=C2)CC3=C(C=CC4=CC=CC=C43)CC(=O)[O-]

InChI

InChI=1S/C25H20O3.C3H5N/c26-25(27)17-20-14-13-19-8-4-5-12-23(19)24(20)16-18-7-6-11-22(15-18)28-21-9-2-1-3-10-21;1-2-3-4/h1-15H,16-17H2,(H,26,27);2H2,1H3/p-1