methyl 6-[(5-hex-1-ynylpyridin-3-yl)carbonylamino]hexanoate

Systemtic Name: methyl 6-[(5-hex-1-ynylpyridin-3-yl)carbonylamino]hexanoate Openeye Name: methyl 6-[(5-hex-1-ynylpyridine-3-carbonyl)amino]hexanoate CAS Name: 6-[[(5-hex-1-ynyl-3-pyridinyl)-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(5-hex-1-ynylpyridine-3-carbonyl)amino]hexanoate Traditional Name: 6-[(5-hex-1-ynylnicotinoyl)amino]hexanoic acid methyl ester Formula: C19H26N2O3 MolecularWeight: 330.42134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CC(=CN=C1)C(=O)NCCCCCC(=O)OC

Isomeric SMILES

CCCCC#CC1=CC(=CN=C1)C(=O)NCCCCCC(=O)OC

InChI

InChI=1S/C19H26N2O3/c1-3-4-5-7-10-16-13-17(15-20-14-16)19(23)21-12-9-6-8-11-18(22)24-2/h13-15H,3-6,8-9,11-12H2,1-2H3,(H,21,23)