(4-tert-butylphenyl)-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]methanone

Systemtic Name: (4-tert-butylphenyl)-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]methanone Openeye Name: (4-tert-butylphenyl)-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]methanone CAS Name: (4-tert-butylphenyl)-[4-(4-methoxy-2-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (4-tert-butylphenyl)-[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (4-tert-butylphenyl)-[4-(4-methoxy-2-nitro-phenyl)piperazino]methanone Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4/c1-22(2,3)17-7-5-16(6-8-17)21(26)24-13-11-23(12-14-24)19-10-9-18(29-4)15-20(19)25(27)28/h5-10,15H,11-14H2,1-4H3