ethyl (2S)-2-[[5-[(4-chloranyl-2-nitro-phenoxy)methyl]furan-2-yl]carbonylamino]-2-phenyl-ethanoate

Systemtic Name: ethyl (2S)-2-[[5-[(4-chloranyl-2-nitro-phenoxy)methyl]furan-2-yl]carbonylamino]-2-phenyl-ethanoate Openeye Name: ethyl (2S)-2-[[5-[(4-chloro-2-nitro-phenoxy)methyl]furan-2-carbonyl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[[5-[(4-chloro-2-nitrophenoxy)methyl]-2-furanyl]-oxomethyl]amino]-2-phenylacetic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[5-[(4-chloro-2-nitrophenoxy)methyl]furan-2-carbonyl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[5-[(4-chloro-2-nitro-phenoxy)methyl]-2-furoyl]amino]-2-phenyl-acetic acid ethyl ester Formula: C22H19ClN2O7 MolecularWeight: 458.84846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)NC(=O)C2=CC=C(O2)COC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)[C@H](C1=CC=CC=C1)NC(=O)C2=CC=C(O2)COC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H19ClN2O7/c1-2-30-22(27)20(14-6-4-3-5-7-14)24-21(26)19-11-9-16(32-19)13-31-18-10-8-15(23)12-17(18)25(28)29/h3-12,20H,2,13H2,1H3,(H,24,26)/t20-/m0/s1