tert-butyl N-[3-[1-(triphenylmethyl)imidazol-4-yl]prop-2-ynyl]carbamate

Systemtic Name: tert-butyl N-[3-[1-(triphenylmethyl)imidazol-4-yl]prop-2-ynyl]carbamate Openeye Name: tert-butyl N-[3-(1-tritylimidazol-4-yl)prop-2-ynyl]carbamate CAS Name: N-[3-[1-(triphenylmethyl)-4-imidazolyl]prop-2-ynyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(1-tritylimidazol-4-yl)prop-2-ynyl]carbamate Traditional Name: N-[3-(1-tritylimidazol-4-yl)prop-2-ynyl]carbamic acid tert-butyl ester Formula: C30H29N3O2 MolecularWeight: 463.57016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC#CC1=CN(C=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)NCC#CC1=CN(C=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H29N3O2/c1-29(2,3)35-28(34)31-21-13-20-27-22-33(23-32-27)30(24-14-7-4-8-15-24,25-16-9-5-10-17-25)26-18-11-6-12-19-26/h4-12,14-19,22-23H,21H2,1-3H3,(H,31,34)