(4-butoxyphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (4-butoxyphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (4-butoxyphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (4-butoxyphenyl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (4-butoxyphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (4-butoxyphenyl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O4/c1-2-3-16-28-20-10-4-17(5-11-20)21(25)23-14-12-22(13-15-23)18-6-8-19(9-7-18)24(26)27/h4-11H,2-3,12-16H2,1H3