N-(4-azanylcyclohexyl)-1-ethanoyl-4-[2-morpholin-4-ylethyl-[(4-nitrophenyl)methyl]amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-ethanoyl-4-[2-morpholin-4-ylethyl-[(4-nitrophenyl)methyl]amino]pyrrolidine-2-carboxamide Openeye Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[2-morpholinoethyl-[(4-nitrophenyl)methyl]amino]pyrrolidine-2-carboxamide CAS Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[2-(4-morpholinyl)ethyl-[(4-nitrophenyl)methyl]amino]-2-pyrrolidinecarboxamide IUPAC Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[2-morpholin-4-ylethyl-[(4-nitrophenyl)methyl]amino]pyrrolidine-2-carboxamide Traditional Name: 1-acetyl-N-(4-aminocyclohexyl)-4-[2-morpholinoethyl-(4-nitrobenzyl)amino]pyrrolidine-2-carboxamide Formula: C26H40N6O5 MolecularWeight: 516.633

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1C(=O)NC2CCC(CC2)N)N(CCN3CCOCC3)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CC(CC1C(=O)NC2CCC(CC2)N)N(CCN3CCOCC3)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H40N6O5/c1-19(33)31-18-24(16-25(31)26(34)28-22-6-4-21(27)5-7-22)30(11-10-29-12-14-37-15-13-29)17-20-2-8-23(9-3-20)32(35)36/h2-3,8-9,21-22,24-25H,4-7,10-18,27H2,1H3,(H,28,34)