ethyl 2-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)amino]pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)amino]pyrimidine-5-carboxylate Openeye Name: ethyl 2-[(1,1,4,4,7-pentamethyltetralin-6-yl)amino]pyrimidine-5-carboxylate CAS Name: 2-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)amino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)amino]pyrimidine-5-carboxylate Traditional Name: 2-[(1,1,4,4,7-pentamethyltetralin-6-yl)amino]pyrimidine-5-carboxylic acid ethyl ester Formula: C22H29N3O2 MolecularWeight: 367.48456

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1)NC2=C(C=C3C(=C2)C(CCC3(C)C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1)NC2=C(C=C3C(=C2)C(CCC3(C)C)(C)C)C

InChI

InChI=1S/C22H29N3O2/c1-7-27-19(26)15-12-23-20(24-13-15)25-18-11-17-16(10-14(18)2)21(3,4)8-9-22(17,5)6/h10-13H,7-9H2,1-6H3,(H,23,24,25)