tert-butyl N-[4-(4-nitrophenyl)but-3-ynyl]carbamate

Systemtic Name: tert-butyl N-[4-(4-nitrophenyl)but-3-ynyl]carbamate Openeye Name: tert-butyl N-[4-(4-nitrophenyl)but-3-ynyl]carbamate CAS Name: N-[4-(4-nitrophenyl)but-3-ynyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(4-nitrophenyl)but-3-ynyl]carbamate Traditional Name: N-[4-(4-nitrophenyl)but-3-ynyl]carbamic acid tert-butyl ester Formula: C15H18N2O4 MolecularWeight: 290.31442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC#CC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NCCC#CC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O4/c1-15(2,3)21-14(18)16-11-5-4-6-12-7-9-13(10-8-12)17(19)20/h7-10H,5,11H2,1-3H3,(H,16,18)