1-[4-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]-2-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]ethanone

Systemtic Name: 1-[4-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]-2-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]ethanone Openeye Name: 1-[4-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone CAS Name: 1-[4-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]-2-[oxo(1-piperazinyl)methyl]-1-pyrrolidinyl]ethanone IUPAC Name: 1-[4-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]-2-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone Traditional Name: 1-[4-[m-anisyl-(4-nitrobenzyl)amino]-2-(piperazine-1-carbonyl)pyrrolidino]ethanone Formula: C26H33N5O5 MolecularWeight: 495.57072

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1C(=O)N2CCNCC2)N(CC3=CC=C(C=C3)[N+](=O)[O-])CC4=CC(=CC=C4)OC

Isomeric SMILES

CC(=O)N1CC(CC1C(=O)N2CCNCC2)N(CC3=CC=C(C=C3)[N+](=O)[O-])CC4=CC(=CC=C4)OC

InChI

InChI=1S/C26H33N5O5/c1-19(32)30-18-23(15-25(30)26(33)28-12-10-27-11-13-28)29(17-21-4-3-5-24(14-21)36-2)16-20-6-8-22(9-7-20)31(34)35/h3-9,14,23,25,27H,10-13,15-18H2,1-2H3