ethyl 2-[(6-chloranylpyrimidin-4-yl)amino]-3-(4-nitrophenyl)propanoate

Systemtic Name: ethyl 2-[(6-chloranylpyrimidin-4-yl)amino]-3-(4-nitrophenyl)propanoate Openeye Name: ethyl 2-[(6-chloropyrimidin-4-yl)amino]-3-(4-nitrophenyl)propanoate CAS Name: 2-[(6-chloro-4-pyrimidinyl)amino]-3-(4-nitrophenyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-[(6-chloropyrimidin-4-yl)amino]-3-(4-nitrophenyl)propanoate Traditional Name: 2-[(6-chloropyrimidin-4-yl)amino]-3-(4-nitrophenyl)propionic acid ethyl ester Formula: C15H15ClN4O4 MolecularWeight: 350.757

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)[N+](=O)[O-])NC2=CC(=NC=N2)Cl

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)[N+](=O)[O-])NC2=CC(=NC=N2)Cl

InChI

InChI=1S/C15H15ClN4O4/c1-2-24-15(21)12(19-14-8-13(16)17-9-18-14)7-10-3-5-11(6-4-10)20(22)23/h3-6,8-9,12H,2,7H2,1H3,(H,17,18,19)