methyl 3-(3-hydroxyphenyl)-2-[2-[2-(3-nitrophenyl)ethanoylamino]propanoylamino]propanoate

Systemtic Name: methyl 3-(3-hydroxyphenyl)-2-[2-[2-(3-nitrophenyl)ethanoylamino]propanoylamino]propanoate Openeye Name: methyl 3-(3-hydroxyphenyl)-2-[2-[[2-(3-nitrophenyl)acetyl]amino]propanoylamino]propanoate CAS Name: 3-(3-hydroxyphenyl)-2-[[2-[[2-(3-nitrophenyl)-1-oxoethyl]amino]-1-oxopropyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(3-hydroxyphenyl)-2-[2-[[2-(3-nitrophenyl)acetyl]amino]propanoylamino]propanoate Traditional Name: 3-(3-hydroxyphenyl)-2-[2-[[2-(3-nitrophenyl)acetyl]amino]propanoylamino]propionic acid methyl ester Formula: C21H23N3O7 MolecularWeight: 429.42322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O7/c1-13(22-19(26)12-14-5-3-7-16(9-14)24(29)30)20(27)23-18(21(28)31-2)11-15-6-4-8-17(25)10-15/h3-10,13,18,25H,11-12H2,1-2H3,(H,22,26)(H,23,27)