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

Systemtic Name: [4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]-(4-propoxyphenyl)methanone Openeye Name: [4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]-(4-propoxyphenyl)methanone CAS Name: [4-(4-methoxy-2-nitrophenyl)-1-piperazinyl]-(4-propoxyphenyl)methanone IUPAC Name: [4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]-(4-propoxyphenyl)methanone Traditional Name: [4-(4-methoxy-2-nitro-phenyl)piperazino]-(4-propoxyphenyl)methanone Formula: C21H25N3O5 MolecularWeight: 399.4403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)OC)[N+](=O)[O-]

InChI

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