ethyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-(phenylmethoxyamino)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-(phenylmethoxyamino)pyrimidine-5-carboxylate Openeye Name: ethyl 4-(benzyloxyamino)-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)pyrimidine-5-carboxylate CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-(phenylmethoxyamino)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-(phenylmethoxyamino)pyrimidine-5-carboxylate Traditional Name: 4-(benzoxyamino)-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)pyrimidine-5-carboxylic acid ethyl ester Formula: C22H22N4O5 MolecularWeight: 422.43388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NOCC2=CC=CC=C2)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NOCC2=CC=CC=C2)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H22N4O5/c1-2-28-21(27)17-13-23-22(24-16-8-9-18-19(12-16)30-11-10-29-18)25-20(17)26-31-14-15-6-4-3-5-7-15/h3-9,12-13H,2,10-11,14H2,1H3,(H2,23,24,25,26)