(2-methyl-3,5-dinitro-phenyl)-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: (2-methyl-3,5-dinitro-phenyl)-(4-phenylpiperazin-1-yl)methanone Openeye Name: (2-methyl-3,5-dinitro-phenyl)-(4-phenylpiperazin-1-yl)methanone CAS Name: (2-methyl-3,5-dinitrophenyl)-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (2-methyl-3,5-dinitrophenyl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: (2-methyl-3,5-dinitro-phenyl)-(4-phenylpiperazino)methanone Formula: C18H18N4O5 MolecularWeight: 370.35932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(=O)N2CCN(CC2)C3=CC=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1C(=O)N2CCN(CC2)C3=CC=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O5/c1-13-16(11-15(21(24)25)12-17(13)22(26)27)18(23)20-9-7-19(8-10-20)14-5-3-2-4-6-14/h2-6,11-12H,7-10H2,1H3