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

Systemtic Name: [4-(3-methylbutoxy)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (4-isopentyloxyphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [4-(3-methylbutoxy)phenyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [4-(3-methylbutoxy)phenyl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (4-isoamoxyphenyl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4/c1-17(2)11-16-29-21-9-3-18(4-10-21)22(26)24-14-12-23(13-15-24)19-5-7-20(8-6-19)25(27)28/h3-10,17H,11-16H2,1-2H3