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1-butan-2-yl-4-[(2,3-dimethoxyphenyl)methyl]piperazine; methanoic acid

1-butan-2-yl-4-[(2,3-dimethoxyphenyl)methyl]piperazine; methanoic acid

Systemtic Name:1-butan-2-yl-4-[(2,3-dimethoxyphenyl)methyl]piperazine; methanoic acid
Openeye Name:1-[(2,3-dimethoxyphenyl)methyl]-4-sec-butyl-piperazine; formic acid
CAS Name:1-butan-2-yl-4-[(2,3-dimethoxyphenyl)methyl]piperazine; formic acid
IUPAC Name:1-butan-2-yl-4-[(2,3-dimethoxyphenyl)methyl]piperazine; formic acid
Traditional Name:formic acid; 1-o-veratryl-4-sec-butyl-piperazine
Formula: C19H32N2O6
MolecularWeight: 384.46718
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CCN(CC1)CC2=C(C(=CC=C2)OC)OC.C(=O)O.C(=O)O


Isomeric SMILES

CCC(C)N1CCN(CC1)CC2=C(C(=CC=C2)OC)OC.C(=O)O.C(=O)O


InChI

InChI=1S/C17H28N2O2.2CH2O2/c1-5-14(2)19-11-9-18(10-12-19)13-15-7-6-8-16(20-3)17(15)21-4;2*2-1-3/h6-8,14H,5,9-13H2,1-4H3;2*1H,(H,2,3)


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