methyl (2R)-2-[2-[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]oxyethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2R)-2-[2-[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]oxyethanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2R)-2-[[2-[(E)-3-(5-nitro-2-furyl)prop-2-enoyl]oxyacetyl]amino]-3-phenyl-propanoate CAS Name: (2R)-2-[[2-[(E)-3-(5-nitro-2-furanyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]oxyacetyl]amino]-3-phenylpropanoate Traditional Name: (2R)-2-[[2-[(E)-3-(5-nitro-2-furyl)acryloyl]oxyacetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C19H18N2O8 MolecularWeight: 402.35482

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)COC(=O)C=CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)COC(=O)/C=C/C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O8/c1-27-19(24)15(11-13-5-3-2-4-6-13)20-16(22)12-28-18(23)10-8-14-7-9-17(29-14)21(25)26/h2-10,15H,11-12H2,1H3,(H,20,22)/b10-8+/t15-/m1/s1