3-[4-[6-[(phenylmethyl)amino]hexyl]-1,2-dihydropyridin-2-yl]prop-2-ynal

Systemtic Name: 3-[4-[6-[(phenylmethyl)amino]hexyl]-1,2-dihydropyridin-2-yl]prop-2-ynal Openeye Name: 3-[4-[6-(benzylamino)hexyl]-1,2-dihydropyridin-2-yl]prop-2-ynal CAS Name: 3-[4-[6-[(phenylmethyl)amino]hexyl]-1,2-dihydropyridin-2-yl]-2-propynal IUPAC Name: 3-[4-[6-(benzylamino)hexyl]-1,2-dihydropyridin-2-yl]prop-2-ynal Traditional Name: 3-[4-[6-(benzylamino)hexyl]-1,2-dihydropyridin-2-yl]propiolaldehyde Formula: C21H26N2O MolecularWeight: 322.44394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCCCCCCC2=CC(NC=C2)C#CC=O

Isomeric SMILES

C1=CC=C(C=C1)CNCCCCCCC2=CC(NC=C2)C#CC=O

InChI

InChI=1S/C21H26N2O/c24-16-8-12-21-17-19(13-15-23-21)9-4-1-2-7-14-22-18-20-10-5-3-6-11-20/h3,5-6,10-11,13,15-17,21-23H,1-2,4,7,9,14,18H2