(2R)-N-(2-azanylethyl)-1-ethanoyl-4-[2-morpholin-4-ylethyl-[(4-nitrophenyl)methyl]amino]piperidine-2-carboxamide

Systemtic Name: (2R)-N-(2-azanylethyl)-1-ethanoyl-4-[2-morpholin-4-ylethyl-[(4-nitrophenyl)methyl]amino]piperidine-2-carboxamide Openeye Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[2-morpholinoethyl-[(4-nitrophenyl)methyl]amino]piperidine-2-carboxamide CAS Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[2-(4-morpholinyl)ethyl-[(4-nitrophenyl)methyl]amino]-2-piperidinecarboxamide IUPAC Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[2-morpholin-4-ylethyl-[(4-nitrophenyl)methyl]amino]piperidine-2-carboxamide Traditional Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[2-morpholinoethyl-(4-nitrobenzyl)amino]pipecolinamide Formula: C23H36N6O5 MolecularWeight: 476.56914

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1C(=O)NCCN)N(CCN2CCOCC2)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCC(C[C@@H]1C(=O)NCCN)N(CCN2CCOCC2)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H36N6O5/c1-18(30)28-9-6-21(16-22(28)23(31)25-8-7-24)27(11-10-26-12-14-34-15-13-26)17-19-2-4-20(5-3-19)29(32)33/h2-5,21-22H,6-17,24H2,1H3,(H,25,31)/t21?,22-/m1/s1