6-[3-(aminomethyl)-2,4-bis(hydroxymethyl)-6-(naphthalen-1-ylmethyl)phenyl]hexanal

Systemtic Name: 6-[3-(aminomethyl)-2,4-bis(hydroxymethyl)-6-(naphthalen-1-ylmethyl)phenyl]hexanal Openeye Name: 6-[3-(aminomethyl)-2,4-bis(hydroxymethyl)-6-(1-naphthylmethyl)phenyl]hexanal CAS Name: 6-[3-(aminomethyl)-2,4-bis(hydroxymethyl)-6-(1-naphthalenylmethyl)phenyl]hexanal IUPAC Name: 6-[3-(aminomethyl)-2,4-bis(hydroxymethyl)-6-(naphthalen-1-ylmethyl)phenyl]hexanal Traditional Name: 6-[3-(aminomethyl)-2,4-dimethylol-6-(1-naphthylmethyl)phenyl]hexanal Formula: C26H31NO3 MolecularWeight: 405.52924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC3=CC(=C(C(=C3CCCCCC=O)CO)CN)CO

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC3=CC(=C(C(=C3CCCCCC=O)CO)CN)CO

InChI

InChI=1S/C26H31NO3/c27-16-25-22(17-29)15-21(24(26(25)18-30)12-3-1-2-6-13-28)14-20-10-7-9-19-8-4-5-11-23(19)20/h4-5,7-11,13,15,29-30H,1-3,6,12,14,16-18,27H2