(2S)-1-[2-azanyl-6-[(4-nitrophenyl)methoxycarbonylamino]hexanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[2-azanyl-6-[(4-nitrophenyl)methoxycarbonylamino]hexanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[2-amino-6-[(4-nitrophenyl)methoxycarbonylamino]hexanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[2-amino-6-[[(4-nitrophenyl)methoxy-oxomethyl]amino]-1-oxohexyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[2-amino-6-[(4-nitrophenyl)methoxycarbonylamino]hexanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[2-amino-6-[(4-nitrobenzyl)oxycarbonylamino]hexanoyl]proline Formula: C19H26N4O7 MolecularWeight: 422.43234

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CCCCNC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])N)C(=O)O

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C(CCCCNC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])N)C(=O)O

InChI

InChI=1S/C19H26N4O7/c20-15(17(24)22-11-3-5-16(22)18(25)26)4-1-2-10-21-19(27)30-12-13-6-8-14(9-7-13)23(28)29/h6-9,15-16H,1-5,10-12,20H2,(H,21,27)(H,25,26)/t15?,16-/m0/s1