3-methyl-N-[3-[4-[3-[(3-methyl-4-nitro-phenyl)carbonylamino]propyl]piperazin-1-yl]propyl]-4-nitro-benzamide

Systemtic Name: 3-methyl-N-[3-[4-[3-[(3-methyl-4-nitro-phenyl)carbonylamino]propyl]piperazin-1-yl]propyl]-4-nitro-benzamide Openeye Name: 3-methyl-N-[3-[4-[3-[(3-methyl-4-nitro-benzoyl)amino]propyl]piperazin-1-yl]propyl]-4-nitro-benzamide CAS Name: 3-methyl-N-[3-[4-[3-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]propyl]-1-piperazinyl]propyl]-4-nitrobenzamide IUPAC Name: 3-methyl-N-[3-[4-[3-[(3-methyl-4-nitrobenzoyl)amino]propyl]piperazin-1-yl]propyl]-4-nitrobenzamide Traditional Name: 3-methyl-N-[3-[4-[3-[(3-methyl-4-nitro-benzoyl)amino]propyl]piperazino]propyl]-4-nitro-benzamide Formula: C26H34N6O6 MolecularWeight: 526.58476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCCCN2CCN(CC2)CCCNC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCCCN2CCN(CC2)CCCNC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C26H34N6O6/c1-19-17-21(5-7-23(19)31(35)36)25(33)27-9-3-11-29-13-15-30(16-14-29)12-4-10-28-26(34)22-6-8-24(32(37)38)20(2)18-22/h5-8,17-18H,3-4,9-16H2,1-2H3,(H,27,33)(H,28,34)