(2S)-2-[(4-nitrophenyl)methoxycarbonylamino]-6-pyrrolidin-1-yl-hexanoic acid

Systemtic Name: (2S)-2-[(4-nitrophenyl)methoxycarbonylamino]-6-pyrrolidin-1-yl-hexanoic acid Openeye Name: (2S)-2-[(4-nitrophenyl)methoxycarbonylamino]-6-pyrrolidin-1-yl-hexanoic acid CAS Name: (2S)-2-[[(4-nitrophenyl)methoxy-oxomethyl]amino]-6-(1-pyrrolidinyl)hexanoic acid IUPAC Name: (2S)-2-[(4-nitrophenyl)methoxycarbonylamino]-6-pyrrolidin-1-ylhexanoic acid Traditional Name: (2S)-2-[(4-nitrobenzyl)oxycarbonylamino]-6-pyrrolidino-hexanoic acid Formula: C18H25N3O6 MolecularWeight: 379.4076

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCCC(C(=O)O)NC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)CCCC[C@@H](C(=O)O)NC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O6/c22-17(23)16(5-1-2-10-20-11-3-4-12-20)19-18(24)27-13-14-6-8-15(9-7-14)21(25)26/h6-9,16H,1-5,10-13H2,(H,19,24)(H,22,23)/t16-/m0/s1