(4-nitrophenyl)methyl (3E)-3-azanyl-3-(1-pyrrolidin-1-ylcarbonylpyrrolidin-2-yl)imino-propanoate

Systemtic Name: (4-nitrophenyl)methyl (3E)-3-azanyl-3-(1-pyrrolidin-1-ylcarbonylpyrrolidin-2-yl)imino-propanoate Openeye Name: (4-nitrophenyl)methyl (3E)-3-amino-3-[1-(pyrrolidine-1-carbonyl)pyrrolidin-2-yl]imino-propanoate CAS Name: (3E)-3-amino-3-[[1-[oxo(1-pyrrolidinyl)methyl]-2-pyrrolidinyl]imino]propanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (3E)-3-amino-3-[1-(pyrrolidine-1-carbonyl)pyrrolidin-2-yl]iminopropanoate Traditional Name: (3E)-3-amino-3-[1-(pyrrolidine-1-carbonyl)pyrrolidin-2-yl]imino-propionic acid (4-nitrobenzyl) ester Formula: C19H25N5O5 MolecularWeight: 403.4323

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)N2CCCC2N=C(CC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])N

Isomeric SMILES

C1CCN(C1)C(=O)N2CCCC2/N=C(\CC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])/N

InChI

InChI=1S/C19H25N5O5/c20-16(12-18(25)29-13-14-5-7-15(8-6-14)24(27)28)21-17-4-3-11-23(17)19(26)22-9-1-2-10-22/h5-8,17H,1-4,9-13H2,(H2,20,21)