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

Systemtic Name: (3-methoxy-4-propan-2-yloxy-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (4-isopropoxy-3-methoxy-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (3-methoxy-4-propan-2-yloxyphenyl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (3-methoxy-4-propan-2-yloxyphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (4-isopropoxy-3-methoxy-phenyl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H25N3O5/c1-15(2)29-19-9-4-16(14-20(19)28-3)21(25)23-12-10-22(11-13-23)17-5-7-18(8-6-17)24(26)27/h4-9,14-15H,10-13H2,1-3H3