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(E)-3-Benzyloxy-5-nitro-1-{5-[4-(3-phenyl-2-propenyl)piperazine-1-yl]-pentyl}-1H-indazole
SpectraBase Compound ID AOwijoWLFae
InChI InChI=1S/C32H37N5O3/c38-37(39)29-16-17-31-30(25-29)32(40-26-28-13-6-2-7-14-28)33-36(31)20-9-3-8-18-34-21-23-35(24-22-34)19-10-15-27-11-4-1-5-12-27/h1-2,4-7,10-17,25H,3,8-9,18-24,26H2/b15-10+
InChIKey QXADCFRDARLVPG-XNTDXEJSSA-N
Mol Weight 539.7 g/mol
Molecular Formula C32H37N5O3
Exact Mass 539.28964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Jx1o661gZb
Name (E)-3-Benzyloxy-5-nitro-1-{5-[4-(3-phenyl-2-propenyl)piperazine-1-yl]-pentyl}-1H-indazole
Alternate Name(s) 5-Nitro-3-phenylmethoxy-1-[5-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]pentyl]indazole 3-Benzyloxy-1-[5-[4-[(E)-cinnamyl]piperazin-1-yl]pentyl]-5-nitro-indazole 5-Nitro-3-phenylmethoxy-1-[5-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]pentyl]indazole
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Formula C32H37N5O3
InChI InChI=1S/C32H37N5O3/c38-37(39)29-16-17-31-30(25-29)32(40-26-28-13-6-2-7-14-28)33-36(31)20-9-3-8-18-34-21-23-35(24-22-34)19-10-15-27-11-4-1-5-12-27/h1-2,4-7,10-17,25H,3,8-9,18-24,26H2/b15-10+
InChIKey QXADCFRDARLVPG-XNTDXEJSSA-N
Molecular Weight 539.680 g/mol
SMILES c12c(n[n](c2ccc(N(=O)=O)c1)CCCCCN1CCN(C\C=C\c2ccccc2)CC1)OCc1ccccc1
SPLASH splash10-00kf-9630240000-dfc7b7d119d13b31c0e2
Source of Spectrum F2-45-2162-33
Wiley ID 1689134