(4-nitrophenyl)methyl 2-[2,6-bis(azanyl)hexanoyl-methoxycarbonyl-amino]propanoate

Systemtic Name: (4-nitrophenyl)methyl 2-[2,6-bis(azanyl)hexanoyl-methoxycarbonyl-amino]propanoate Openeye Name: (4-nitrophenyl)methyl 2-[2,6-diaminohexanoyl(methoxycarbonyl)amino]propanoate CAS Name: 2-[(2,6-diamino-1-oxohexyl)-methoxycarbonylamino]propanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[2,6-diaminohexanoyl(methoxycarbonyl)amino]propanoate Traditional Name: 2-[carbomethoxy(2,6-diaminohexanoyl)amino]propionic acid (4-nitrobenzyl) ester Formula: C18H26N4O7 MolecularWeight: 410.42164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])N(C(=O)C(CCCCN)N)C(=O)OC

Isomeric SMILES

CC(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])N(C(=O)C(CCCCN)N)C(=O)OC

InChI

InChI=1S/C18H26N4O7/c1-12(17(24)29-11-13-6-8-14(9-7-13)22(26)27)21(18(25)28-2)16(23)15(20)5-3-4-10-19/h6-9,12,15H,3-5,10-11,19-20H2,1-2H3