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

Systemtic Name: (3-butoxyphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (3-butoxyphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (3-butoxyphenyl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (3-butoxyphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (3-butoxyphenyl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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