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1-[2,6-bis(azanyl)hexanoyl]-5-(hydroxymethyl)pyrrole-2-carbaldehyde

1-[2,6-bis(azanyl)hexanoyl]-5-(hydroxymethyl)pyrrole-2-carbaldehyde

Systemtic Name:1-[2,6-bis(azanyl)hexanoyl]-5-(hydroxymethyl)pyrrole-2-carbaldehyde
Openeye Name:1-(2,6-diaminohexanoyl)-5-(hydroxymethyl)pyrrole-2-carbaldehyde
CAS Name:1-(2,6-diamino-1-oxohexyl)-5-(hydroxymethyl)-2-pyrrolecarboxaldehyde
IUPAC Name:1-(2,6-diaminohexanoyl)-5-(hydroxymethyl)pyrrole-2-carbaldehyde
Traditional Name:1-(2,6-diaminohexanoyl)-5-methylol-pyrrole-2-carbaldehyde
Formula: C12H19N3O3
MolecularWeight: 253.29756
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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N(C(=C1)C=O)C(=O)C(CCCCN)N)CO


Isomeric SMILES

C1=C(N(C(=C1)C=O)C(=O)C(CCCCN)N)CO


InChI

InChI=1S/C12H19N3O3/c13-6-2-1-3-11(14)12(18)15-9(7-16)4-5-10(15)8-17/h4-5,7,11,17H,1-3,6,8,13-14H2


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