(4-methoxyphenyl)-[4-(3-methyl-4-nitro-phenyl)carbonylpiperazin-1-yl]methanone

Systemtic Name: (4-methoxyphenyl)-[4-(3-methyl-4-nitro-phenyl)carbonylpiperazin-1-yl]methanone Openeye Name: (4-methoxyphenyl)-[4-(3-methyl-4-nitro-benzoyl)piperazin-1-yl]methanone CAS Name: (4-methoxyphenyl)-[4-[(3-methyl-4-nitrophenyl)-oxomethyl]-1-piperazinyl]methanone IUPAC Name: (4-methoxyphenyl)-[4-(3-methyl-4-nitrobenzoyl)piperazin-1-yl]methanone Traditional Name: (4-methoxyphenyl)-[4-(3-methyl-4-nitro-benzoyl)piperazino]methanone Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O5/c1-14-13-16(5-8-18(14)23(26)27)20(25)22-11-9-21(10-12-22)19(24)15-3-6-17(28-2)7-4-15/h3-8,13H,9-12H2,1-2H3