(4-nitrophenyl)methyl N-[C-methyl-N-[(1-pyrrolidin-1-ylcarbonylpyrrolidin-3-yl)methyl]carbonimidoyl]carbamate

Systemtic Name: (4-nitrophenyl)methyl N-[C-methyl-N-[(1-pyrrolidin-1-ylcarbonylpyrrolidin-3-yl)methyl]carbonimidoyl]carbamate Openeye Name: (4-nitrophenyl)methyl N-[C-methyl-N-[[1-(pyrrolidine-1-carbonyl)pyrrolidin-3-yl]methyl]carbonimidoyl]carbamate CAS Name: N-[1-[[1-[oxo(1-pyrrolidinyl)methyl]-3-pyrrolidinyl]methylimino]ethyl]carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-[C-methyl-N-[[1-(pyrrolidine-1-carbonyl)pyrrolidin-3-yl]methyl]carbonimidoyl]carbamate Traditional Name: N-[C-methyl-N-[[1-(pyrrolidine-1-carbonyl)pyrrolidin-3-yl]methyl]carbonimidoyl]carbamic acid (4-nitrobenzyl) ester Formula: C20H27N5O5 MolecularWeight: 417.45888

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCC1CCN(C1)C(=O)N2CCCC2)NC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=NCC1CCN(C1)C(=O)N2CCCC2)NC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H27N5O5/c1-15(22-19(26)30-14-16-4-6-18(7-5-16)25(28)29)21-12-17-8-11-24(13-17)20(27)23-9-2-3-10-23/h4-7,17H,2-3,8-14H2,1H3,(H,21,22,26)