(4-ethylphenyl)-[4-(3,4,5-trimethoxy-2-nitro-phenyl)carbonylpiperazin-1-yl]methanone

Systemtic Name: (4-ethylphenyl)-[4-(3,4,5-trimethoxy-2-nitro-phenyl)carbonylpiperazin-1-yl]methanone Openeye Name: (4-ethylphenyl)-[4-(3,4,5-trimethoxy-2-nitro-benzoyl)piperazin-1-yl]methanone CAS Name: (4-ethylphenyl)-[4-[oxo-(3,4,5-trimethoxy-2-nitrophenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (4-ethylphenyl)-[4-(3,4,5-trimethoxy-2-nitrobenzoyl)piperazin-1-yl]methanone Traditional Name: (4-ethylphenyl)-[4-(3,4,5-trimethoxy-2-nitro-benzoyl)piperazino]methanone Formula: C23H27N3O7 MolecularWeight: 457.47638

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC(=C(C(=C3[N+](=O)[O-])OC)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC(=C(C(=C3[N+](=O)[O-])OC)OC)OC

InChI

InChI=1S/C23H27N3O7/c1-5-15-6-8-16(9-7-15)22(27)24-10-12-25(13-11-24)23(28)17-14-18(31-2)20(32-3)21(33-4)19(17)26(29)30/h6-9,14H,5,10-13H2,1-4H3