[3-methoxy-4-(2-methylpropoxy)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: [3-methoxy-4-(2-methylpropoxy)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (4-isobutoxy-3-methoxy-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [3-methoxy-4-(2-methylpropoxy)phenyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [3-methoxy-4-(2-methylpropoxy)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (4-isobutoxy-3-methoxy-phenyl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H27N3O5/c1-16(2)15-30-20-9-4-17(14-21(20)29-3)22(26)24-12-10-23(11-13-24)18-5-7-19(8-6-18)25(27)28/h4-9,14,16H,10-13,15H2,1-3H3