[4-(2,3-dimethylphenyl)piperazin-1-yl]-(4-ethoxy-3-nitro-phenyl)methanone

Systemtic Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(4-ethoxy-3-nitro-phenyl)methanone Openeye Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(4-ethoxy-3-nitro-phenyl)methanone CAS Name: [4-(2,3-dimethylphenyl)-1-piperazinyl]-(4-ethoxy-3-nitrophenyl)methanone IUPAC Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(4-ethoxy-3-nitrophenyl)methanone Traditional Name: [4-(2,3-dimethylphenyl)piperazino]-(4-ethoxy-3-nitro-phenyl)methanone Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O4/c1-4-28-20-9-8-17(14-19(20)24(26)27)21(25)23-12-10-22(11-13-23)18-7-5-6-15(2)16(18)3/h5-9,14H,4,10-13H2,1-3H3