(4-nitrophenyl)methyl 3-azanylidene-3-[methyl-[(1-pyrrolidin-1-ylcarbonylpyrrolidin-3-yl)methyl]amino]propanoate

Systemtic Name: (4-nitrophenyl)methyl 3-azanylidene-3-[methyl-[(1-pyrrolidin-1-ylcarbonylpyrrolidin-3-yl)methyl]amino]propanoate Openeye Name: (4-nitrophenyl)methyl 3-imino-3-[methyl-[[1-(pyrrolidine-1-carbonyl)pyrrolidin-3-yl]methyl]amino]propanoate CAS Name: 3-imino-3-[methyl-[[1-[oxo(1-pyrrolidinyl)methyl]-3-pyrrolidinyl]methyl]amino]propanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-imino-3-[methyl-[[1-(pyrrolidine-1-carbonyl)pyrrolidin-3-yl]methyl]amino]propanoate Traditional Name: 3-imino-3-[methyl-[[1-(pyrrolidine-1-carbonyl)pyrrolidin-3-yl]methyl]amino]propionic acid (4-nitrobenzyl) ester Formula: C21H29N5O5 MolecularWeight: 431.48546

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCN(C1)C(=O)N2CCCC2)C(=N)CC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1CCN(C1)C(=O)N2CCCC2)C(=N)CC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H29N5O5/c1-23(13-17-8-11-25(14-17)21(28)24-9-2-3-10-24)19(22)12-20(27)31-15-16-4-6-18(7-5-16)26(29)30/h4-7,17,22H,2-3,8-15H2,1H3