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

Systemtic Name: 2-[1-[(3-phenoxyphenyl)methyl]naphthalen-2-yl]ethanoate; propane Openeye Name: 2-[1-[(3-phenoxyphenyl)methyl]-2-naphthyl]acetate; propane CAS Name: 2-[1-[(3-phenoxyphenyl)methyl]-2-naphthalenyl]acetate; propane IUPAC Name: 2-[1-[(3-phenoxyphenyl)methyl]naphthalen-2-yl]acetate; propane Traditional Name: n-propane; 2-[1-(3-phenoxybenzyl)-2-naphthyl]acetate Formula: C28H27O3- MolecularWeight: 411.51218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H20O3.C3H8/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;1-3-2/h1-15H,16-17H2,(H,26,27);3H2,1-2H3/p-1