tert-butyl N-[(5-cyano-1-methyl-pyrrol-2-yl)methyl]carbamate

Systemtic Name: tert-butyl N-[(5-cyano-1-methyl-pyrrol-2-yl)methyl]carbamate Openeye Name: tert-butyl N-[(5-cyano-1-methyl-pyrrol-2-yl)methyl]carbamate CAS Name: N-[(5-cyano-1-methyl-2-pyrrolyl)methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(5-cyano-1-methylpyrrol-2-yl)methyl]carbamate Traditional Name: N-[(5-cyano-1-methyl-pyrrol-2-yl)methyl]carbamic acid tert-butyl ester Formula: C12H17N3O2 MolecularWeight: 235.28228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(N1C)C#N

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(N1C)C#N

InChI

InChI=1S/C12H17N3O2/c1-12(2,3)17-11(16)14-8-10-6-5-9(7-13)15(10)4/h5-6H,8H2,1-4H3,(H,14,16)