ethyl 4-[(5,5-dimethyl-8-thiophen-2-yl-6H-naphthalen-2-yl)diazenyl]benzoate

Systemtic Name: ethyl 4-[(5,5-dimethyl-8-thiophen-2-yl-6H-naphthalen-2-yl)diazenyl]benzoate Openeye Name: ethyl 4-[[5,5-dimethyl-8-(2-thienyl)-6H-naphthalen-2-yl]azo]benzoate CAS Name: 4-[(5,5-dimethyl-8-thiophen-2-yl-6H-naphthalen-2-yl)azo]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(5,5-dimethyl-8-thiophen-2-yl-6H-naphthalen-2-yl)diazenyl]benzoate Traditional Name: 4-[[5,5-dimethyl-8-(2-thienyl)-6H-naphthalen-2-yl]azo]benzoic acid ethyl ester Formula: C25H24N2O2S MolecularWeight: 416.53526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=NC2=CC3=C(C=C2)C(CC=C3C4=CC=CS4)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=NC2=CC3=C(C=C2)C(CC=C3C4=CC=CS4)(C)C

InChI

InChI=1S/C25H24N2O2S/c1-4-29-24(28)17-7-9-18(10-8-17)26-27-19-11-12-22-21(16-19)20(13-14-25(22,2)3)23-6-5-15-30-23/h5-13,15-16H,4,14H2,1-3H3