3-(4-nitrophenyl)-2-[2-(1-phenylmethoxycarbonylpiperidin-4-yl)oxyethanoylamino]propanoic acid

Systemtic Name: 3-(4-nitrophenyl)-2-[2-(1-phenylmethoxycarbonylpiperidin-4-yl)oxyethanoylamino]propanoic acid Openeye Name: 2-[[2-[(1-benzyloxycarbonyl-4-piperidyl)oxy]acetyl]amino]-3-(4-nitrophenyl)propanoic acid CAS Name: 3-(4-nitrophenyl)-2-[[1-oxo-2-[(1-phenylmethoxycarbonyl-4-piperidinyl)oxy]ethyl]amino]propanoic acid IUPAC Name: 3-(4-nitrophenyl)-2-[[2-(1-phenylmethoxycarbonylpiperidin-4-yl)oxyacetyl]amino]propanoic acid Traditional Name: 2-[[2-[(1-carbobenzoxy-4-piperidyl)oxy]acetyl]amino]-3-(4-nitrophenyl)propionic acid Formula: C24H27N3O8 MolecularWeight: 485.48648

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OCC(=O)NC(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1OCC(=O)NC(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H27N3O8/c28-22(25-21(23(29)30)14-17-6-8-19(9-7-17)27(32)33)16-34-20-10-12-26(13-11-20)24(31)35-15-18-4-2-1-3-5-18/h1-9,20-21H,10-16H2,(H,25,28)(H,29,30)