ethyl 4-[[8-(2-ethoxy-2-oxidanylidene-ethyl)-5,5-dimethyl-8-oxidanyl-6,7-dihydronaphthalen-2-yl]diazenyl]benzoate

Systemtic Name: ethyl 4-[[8-(2-ethoxy-2-oxidanylidene-ethyl)-5,5-dimethyl-8-oxidanyl-6,7-dihydronaphthalen-2-yl]diazenyl]benzoate Openeye Name: ethyl 4-[4-(2-ethoxy-2-oxo-ethyl)-4-hydroxy-1,1-dimethyl-tetralin-6-yl]azobenzoate CAS Name: 4-[[8-(2-ethoxy-2-oxoethyl)-8-hydroxy-5,5-dimethyl-6,7-dihydronaphthalen-2-yl]azo]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[8-(2-ethoxy-2-oxoethyl)-8-hydroxy-5,5-dimethyl-6,7-dihydronaphthalen-2-yl]diazenyl]benzoate Traditional Name: 4-[4-(2-ethoxy-2-keto-ethyl)-4-hydroxy-1,1-dimethyl-tetralin-6-yl]azobenzoic acid ethyl ester Formula: C25H30N2O5 MolecularWeight: 438.5161

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1(CCC(C2=C1C=C(C=C2)N=NC3=CC=C(C=C3)C(=O)OCC)(C)C)O

Isomeric SMILES

CCOC(=O)CC1(CCC(C2=C1C=C(C=C2)N=NC3=CC=C(C=C3)C(=O)OCC)(C)C)O

InChI

InChI=1S/C25H30N2O5/c1-5-31-22(28)16-25(30)14-13-24(3,4)20-12-11-19(15-21(20)25)27-26-18-9-7-17(8-10-18)23(29)32-6-2/h7-12,15,30H,5-6,13-14,16H2,1-4H3