methyl 4-[1-[8-(2-imidazol-1-ylphenyl)-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoate

Systemtic Name: methyl 4-[1-[8-(2-imidazol-1-ylphenyl)-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoate Openeye Name: methyl 4-[1-[8-(2-imidazol-1-ylphenyl)-5,5-dimethyl-6H-naphthalen-2-yl]vinyl]benzoate CAS Name: 4-[1-[8-[2-(1-imidazolyl)phenyl]-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-[8-(2-imidazol-1-ylphenyl)-5,5-dimethyl-6H-naphthalen-2-yl]ethenyl]benzoate Traditional Name: 4-[1-[8-(2-imidazol-1-ylphenyl)-5,5-dimethyl-6H-naphthalen-2-yl]vinyl]benzoic acid methyl ester Formula: C31H28N2O2 MolecularWeight: 460.56622

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=C(C2=C1C=CC(=C2)C(=C)C3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4N5C=CN=C5)C

Isomeric SMILES

CC1(CC=C(C2=C1C=CC(=C2)C(=C)C3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4N5C=CN=C5)C

InChI

InChI=1S/C31H28N2O2/c1-21(22-9-11-23(12-10-22)30(34)35-4)24-13-14-28-27(19-24)25(15-16-31(28,2)3)26-7-5-6-8-29(26)33-18-17-32-20-33/h5-15,17-20H,1,16H2,2-4H3