methyl 2-[2-[(E)-3-(2-nitrophenyl)prop-2-enoyl]oxyethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[2-[(E)-3-(2-nitrophenyl)prop-2-enoyl]oxyethanoylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[[2-[(E)-3-(2-nitrophenyl)prop-2-enoyl]oxyacetyl]amino]-3-phenyl-propanoate CAS Name: 2-[[2-[(E)-3-(2-nitrophenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(E)-3-(2-nitrophenyl)prop-2-enoyl]oxyacetyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-[(E)-3-(2-nitrophenyl)acryloyl]oxyacetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C21H20N2O7 MolecularWeight: 412.3927

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)COC(=O)C=CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O7/c1-29-21(26)17(13-15-7-3-2-4-8-15)22-19(24)14-30-20(25)12-11-16-9-5-6-10-18(16)23(27)28/h2-12,17H,13-14H2,1H3,(H,22,24)/b12-11+