tert-butyl N-[2-[[1-(3-methylbutyl)-4-nitro-pyrrol-2-yl]carbonylamino]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[[1-(3-methylbutyl)-4-nitro-pyrrol-2-yl]carbonylamino]ethyl]carbamate Openeye Name: tert-butyl N-[2-[(1-isopentyl-4-nitro-pyrrole-2-carbonyl)amino]ethyl]carbamate CAS Name: N-[2-[[[1-(3-methylbutyl)-4-nitro-2-pyrrolyl]-oxomethyl]amino]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[[1-(3-methylbutyl)-4-nitropyrrole-2-carbonyl]amino]ethyl]carbamate Traditional Name: N-[2-[(1-isoamyl-4-nitro-pyrrole-2-carbonyl)amino]ethyl]carbamic acid tert-butyl ester Formula: C17H28N4O5 MolecularWeight: 368.42802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=C(C=C1C(=O)NCCNC(=O)OC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCN1C=C(C=C1C(=O)NCCNC(=O)OC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H28N4O5/c1-12(2)6-9-20-11-13(21(24)25)10-14(20)15(22)18-7-8-19-16(23)26-17(3,4)5/h10-12H,6-9H2,1-5H3,(H,18,22)(H,19,23)