1-[4-[2-methoxyethyl-[(4-nitrophenyl)methyl]amino]-2-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]ethanone

Systemtic Name: 1-[4-[2-methoxyethyl-[(4-nitrophenyl)methyl]amino]-2-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]ethanone Openeye Name: 1-[4-[2-methoxyethyl-[(4-nitrophenyl)methyl]amino]-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone CAS Name: 1-[4-[2-methoxyethyl-[(4-nitrophenyl)methyl]amino]-2-[oxo(1-piperazinyl)methyl]-1-pyrrolidinyl]ethanone IUPAC Name: 1-[4-[2-methoxyethyl-[(4-nitrophenyl)methyl]amino]-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone Traditional Name: 1-[4-[2-methoxyethyl-(4-nitrobenzyl)amino]-2-(piperazine-1-carbonyl)pyrrolidino]ethanone Formula: C21H31N5O5 MolecularWeight: 433.50134

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1C(=O)N2CCNCC2)N(CCOC)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CC(CC1C(=O)N2CCNCC2)N(CCOC)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H31N5O5/c1-16(27)25-15-19(13-20(25)21(28)23-9-7-22-8-10-23)24(11-12-31-2)14-17-3-5-18(6-4-17)26(29)30/h3-6,19-20,22H,7-15H2,1-2H3