ethyl (2S)-2-[(3-chloranylpyrazin-2-yl)amino]-3-(4-nitrophenyl)propanoate

Systemtic Name: ethyl (2S)-2-[(3-chloranylpyrazin-2-yl)amino]-3-(4-nitrophenyl)propanoate Openeye Name: ethyl (2S)-2-[(3-chloropyrazin-2-yl)amino]-3-(4-nitrophenyl)propanoate CAS Name: (2S)-2-[(3-chloro-2-pyrazinyl)amino]-3-(4-nitrophenyl)propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[(3-chloropyrazin-2-yl)amino]-3-(4-nitrophenyl)propanoate Traditional Name: (2S)-2-[(3-chloropyrazin-2-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=NC=CN=C2Cl

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])NC2=NC=CN=C2Cl

InChI

InChI=1S/C15H15ClN4O4/c1-2-24-15(21)12(19-14-13(16)17-7-8-18-14)9-10-3-5-11(6-4-10)20(22)23/h3-8,12H,2,9H2,1H3,(H,18,19)/t12-/m0/s1