(3S)-N,N-bis(phenylmethyl)-1-pyridin-2-yl-hept-1-yn-3-amine

Systemtic Name: (3S)-N,N-bis(phenylmethyl)-1-pyridin-2-yl-hept-1-yn-3-amine Openeye Name: (3S)-N,N-dibenzyl-1-(2-pyridyl)hept-1-yn-3-amine CAS Name: (3S)-N,N-bis(phenylmethyl)-1-(2-pyridinyl)-1-heptyn-3-amine IUPAC Name: (3S)-N,N-dibenzyl-1-pyridin-2-ylhept-1-yn-3-amine Traditional Name: dibenzyl-[(1S)-1-butyl-3-(2-pyridyl)prop-2-ynyl]amine Formula: C26H28N2 MolecularWeight: 368.51392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C#CC1=CC=CC=N1)N(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCCC[C@@H](C#CC1=CC=CC=N1)N(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C26H28N2/c1-2-3-17-26(19-18-25-16-10-11-20-27-25)28(21-23-12-6-4-7-13-23)22-24-14-8-5-9-15-24/h4-16,20,26H,2-3,17,21-22H2,1H3/t26-/m0/s1