2-[1-[1-cyano-2-methyl-1-(3-phenoxyphenyl)butyl]naphthalen-2-yl]ethanoate

Systemtic Name: 2-[1-[1-cyano-2-methyl-1-(3-phenoxyphenyl)butyl]naphthalen-2-yl]ethanoate Openeye Name: 2-[1-[1-cyano-2-methyl-1-(3-phenoxyphenyl)butyl]-2-naphthyl]acetate CAS Name: 2-[1-[1-cyano-2-methyl-1-(3-phenoxyphenyl)butyl]-2-naphthalenyl]acetate IUPAC Name: 2-[1-[1-cyano-2-methyl-1-(3-phenoxyphenyl)butyl]naphthalen-2-yl]acetate Traditional Name: 2-[1-[1-cyano-2-methyl-1-(3-phenoxyphenyl)butyl]-2-naphthyl]acetate Formula: C30H26NO3- MolecularWeight: 448.53234

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C#N)(C1=CC(=CC=C1)OC2=CC=CC=C2)C3=C(C=CC4=CC=CC=C43)CC(=O)[O-]

Isomeric SMILES

CCC(C)C(C#N)(C1=CC(=CC=C1)OC2=CC=CC=C2)C3=C(C=CC4=CC=CC=C43)CC(=O)[O-]

InChI

InChI=1S/C30H27NO3/c1-3-21(2)30(20-31,24-11-9-14-26(19-24)34-25-12-5-4-6-13-25)29-23(18-28(32)33)17-16-22-10-7-8-15-27(22)29/h4-17,19,21H,3,18H2,1-2H3,(H,32,33)/p-1