tert-butyl N,N-bis(3-pyridin-4-ylprop-2-ynyl)carbamate

Systemtic Name: tert-butyl N,N-bis(3-pyridin-4-ylprop-2-ynyl)carbamate Openeye Name: tert-butyl N,N-bis[3-(4-pyridyl)prop-2-ynyl]carbamate CAS Name: N,N-bis(3-pyridin-4-ylprop-2-ynyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N,N-bis(3-pyridin-4-ylprop-2-ynyl)carbamate Traditional Name: N,N-bis[3-(4-pyridyl)prop-2-ynyl]carbamic acid tert-butyl ester Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC#CC1=CC=NC=C1)CC#CC2=CC=NC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N(CC#CC1=CC=NC=C1)CC#CC2=CC=NC=C2

InChI

InChI=1S/C21H21N3O2/c1-21(2,3)26-20(25)24(16-4-6-18-8-12-22-13-9-18)17-5-7-19-10-14-23-15-11-19/h8-15H,16-17H2,1-3H3