ethyl 2-[6,7-dimethoxy-3-phenyl-4-(2-phenylethynyl)naphthalen-2-yl]ethanoate

Systemtic Name: ethyl 2-[6,7-dimethoxy-3-phenyl-4-(2-phenylethynyl)naphthalen-2-yl]ethanoate Openeye Name: ethyl 2-[6,7-dimethoxy-3-phenyl-4-(2-phenylethynyl)-2-naphthyl]acetate CAS Name: 2-[6,7-dimethoxy-3-phenyl-4-(2-phenylethynyl)-2-naphthalenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6,7-dimethoxy-3-phenyl-4-(2-phenylethynyl)naphthalen-2-yl]acetate Traditional Name: 2-[6,7-dimethoxy-3-phenyl-4-(2-phenylethynyl)-2-naphthyl]acetic acid ethyl ester Formula: C30H26O4 MolecularWeight: 450.52504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(=C2C=C(C(=CC2=C1)OC)OC)C#CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CC1=C(C(=C2C=C(C(=CC2=C1)OC)OC)C#CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H26O4/c1-4-34-29(31)19-24-17-23-18-27(32-2)28(33-3)20-26(23)25(16-15-21-11-7-5-8-12-21)30(24)22-13-9-6-10-14-22/h5-14,17-18,20H,4,19H2,1-3H3