[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-(3,4,5-trimethoxy-2-nitro-phenyl)methanone

Systemtic Name: [4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-(3,4,5-trimethoxy-2-nitro-phenyl)methanone Openeye Name: [4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-(3,4,5-trimethoxy-2-nitro-phenyl)methanone CAS Name: [4-[(4-methoxyphenyl)methyl]-1-piperazinyl]-(3,4,5-trimethoxy-2-nitrophenyl)methanone IUPAC Name: [4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-(3,4,5-trimethoxy-2-nitrophenyl)methanone Traditional Name: (4-p-anisylpiperazino)-(3,4,5-trimethoxy-2-nitro-phenyl)methanone Formula: C22H27N3O7 MolecularWeight: 445.46568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=C(C(=C3[N+](=O)[O-])OC)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=C(C(=C3[N+](=O)[O-])OC)OC)OC

InChI

InChI=1S/C22H27N3O7/c1-29-16-7-5-15(6-8-16)14-23-9-11-24(12-10-23)22(26)17-13-18(30-2)20(31-3)21(32-4)19(17)25(27)28/h5-8,13H,9-12,14H2,1-4H3