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

Systemtic Name: methyl 2-[2-[2-(3-nitrophenyl)ethanoylamino]propanoylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[2-[[2-(3-nitrophenyl)acetyl]amino]propanoylamino]-3-phenyl-propanoate CAS Name: 2-[[2-[[2-(3-nitrophenyl)-1-oxoethyl]amino]-1-oxopropyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[2-[[2-(3-nitrophenyl)acetyl]amino]propanoylamino]-3-phenylpropanoate Traditional Name: 2-[2-[[2-(3-nitrophenyl)acetyl]amino]propanoylamino]-3-phenyl-propionic acid methyl ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O6/c1-14(22-19(25)13-16-9-6-10-17(11-16)24(28)29)20(26)23-18(21(27)30-2)12-15-7-4-3-5-8-15/h3-11,14,18H,12-13H2,1-2H3,(H,22,25)(H,23,26)