[4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone

Systemtic Name: [4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone Openeye Name: [4-(2-chloro-6-nitro-phenyl)piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone CAS Name: [4-(2-chloro-6-nitrophenyl)-1-piperazinyl]-(3,4,5-triethoxyphenyl)methanone IUPAC Name: [4-(2-chloro-6-nitrophenyl)piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone Traditional Name: [4-(2-chloro-6-nitro-phenyl)piperazino]-(3,4,5-triethoxyphenyl)methanone Formula: C23H28ClN3O6 MolecularWeight: 477.93792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H28ClN3O6/c1-4-31-19-14-16(15-20(32-5-2)22(19)33-6-3)23(28)26-12-10-25(11-13-26)21-17(24)8-7-9-18(21)27(29)30/h7-9,14-15H,4-6,10-13H2,1-3H3