methyl 6-(4-tert-butylphenyl)-7-thia-5-azaspiro[2.4]hept-5-ene-4-carboxylate

Systemtic Name: methyl 6-(4-tert-butylphenyl)-7-thia-5-azaspiro[2.4]hept-5-ene-4-carboxylate Openeye Name: methyl 6-(4-tert-butylphenyl)-7-thia-5-azaspiro[2.4]hept-5-ene-4-carboxylate CAS Name: 6-(4-tert-butylphenyl)-7-thia-5-azaspiro[2.4]hept-5-ene-4-carboxylic acid methyl ester IUPAC Name: methyl 6-(4-tert-butylphenyl)-7-thia-5-azaspiro[2.4]hept-5-ene-4-carboxylate Traditional Name: 6-(4-tert-butylphenyl)-7-thia-5-azaspiro[2.4]hept-5-ene-4-carboxylic acid methyl ester Formula: C17H21NO2S MolecularWeight: 303.41914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC(C3(S2)CC3)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC(C3(S2)CC3)C(=O)OC

InChI

InChI=1S/C17H21NO2S/c1-16(2,3)12-7-5-11(6-8-12)14-18-13(15(19)20-4)17(21-14)9-10-17/h5-8,13H,9-10H2,1-4H3