(4-nitrophenyl)methyl 2-azanyl-2-[1-(1-methylpyrrolidin-2-yl)carbonylpyrrolidin-3-yl]imino-ethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-azanyl-2-[1-(1-methylpyrrolidin-2-yl)carbonylpyrrolidin-3-yl]imino-ethanoate Openeye Name: (4-nitrophenyl)methyl 2-amino-2-[1-(1-methylpyrrolidine-2-carbonyl)pyrrolidin-3-yl]imino-acetate CAS Name: 2-amino-2-[[1-[(1-methyl-2-pyrrolidinyl)-oxomethyl]-3-pyrrolidinyl]imino]acetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-amino-2-[1-(1-methylpyrrolidine-2-carbonyl)pyrrolidin-3-yl]iminoacetate Traditional Name: 2-amino-2-(1-hygroylpyrrolidin-3-yl)imino-acetic acid (4-nitrobenzyl) ester Formula: C19H25N5O5 MolecularWeight: 403.4323

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1C(=O)N2CCC(C2)N=C(C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])N

Isomeric SMILES

CN1CCCC1C(=O)N2CCC(C2)N=C(C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])N

InChI

InChI=1S/C19H25N5O5/c1-22-9-2-3-16(22)18(25)23-10-8-14(11-23)21-17(20)19(26)29-12-13-4-6-15(7-5-13)24(27)28/h4-7,14,16H,2-3,8-12H2,1H3,(H2,20,21)