(5-ethoxy-4-methoxy-2-nitro-phenyl)-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (5-ethoxy-4-methoxy-2-nitro-phenyl)-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone Openeye Name: (5-ethoxy-4-methoxy-2-nitro-phenyl)-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone CAS Name: (5-ethoxy-4-methoxy-2-nitrophenyl)-[4-[(4-methoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (5-ethoxy-4-methoxy-2-nitrophenyl)-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (5-ethoxy-4-methoxy-2-nitro-phenyl)-(4-p-anisylpiperazino)methanone Formula: C22H27N3O6 MolecularWeight: 429.46628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)OC)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)OC)[N+](=O)[O-])OC

InChI

InChI=1S/C22H27N3O6/c1-4-31-21-13-18(19(25(27)28)14-20(21)30-3)22(26)24-11-9-23(10-12-24)15-16-5-7-17(29-2)8-6-16/h5-8,13-14H,4,9-12,15H2,1-3H3