4-[3,5-dinitro-2,4-di(piperidin-1-yl)phenyl]carbonyl-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[3,5-dinitro-2,4-di(piperidin-1-yl)phenyl]carbonyl-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[3,5-dinitro-2,4-bis(1-piperidyl)benzoyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[[3,5-dinitro-2,4-bis(1-piperidinyl)phenyl]-oxomethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[3,5-dinitro-2,4-di(piperidin-1-yl)benzoyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-(3,5-dinitro-2,4-dipiperidino-benzoyl)-1,3-dihydroquinoxalin-2-one Formula: C25H28N6O6 MolecularWeight: 508.52642

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=C(C=C2C(=O)N3CC(=O)NC4=CC=CC=C43)[N+](=O)[O-])N5CCCCC5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C(=C(C=C2C(=O)N3CC(=O)NC4=CC=CC=C43)[N+](=O)[O-])N5CCCCC5)[N+](=O)[O-]

InChI

InChI=1S/C25H28N6O6/c32-21-16-29(19-10-4-3-9-18(19)26-21)25(33)17-15-20(30(34)35)23(28-13-7-2-8-14-28)24(31(36)37)22(17)27-11-5-1-6-12-27/h3-4,9-10,15H,1-2,5-8,11-14,16H2,(H,26,32)