tert-butyl N-[3-oxidanylidene-3-[6-(prop-2-enoylamino)hexylamino]propyl]carbamate

Systemtic Name: tert-butyl N-[3-oxidanylidene-3-[6-(prop-2-enoylamino)hexylamino]propyl]carbamate Openeye Name: tert-butyl N-[3-oxo-3-[6-(prop-2-enoylamino)hexylamino]propyl]carbamate CAS Name: N-[3-oxo-3-[6-(1-oxoprop-2-enylamino)hexylamino]propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-oxo-3-[6-(prop-2-enoylamino)hexylamino]propyl]carbamate Traditional Name: N-[3-(6-acrylamidohexylamino)-3-keto-propyl]carbamic acid tert-butyl ester Formula: C17H31N3O4 MolecularWeight: 341.44574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(=O)NCCCCCCNC(=O)C=C

Isomeric SMILES

CC(C)(C)OC(=O)NCCC(=O)NCCCCCCNC(=O)C=C

InChI

InChI=1S/C17H31N3O4/c1-5-14(21)18-11-8-6-7-9-12-19-15(22)10-13-20-16(23)24-17(2,3)4/h5H,1,6-13H2,2-4H3,(H,18,21)(H,19,22)(H,20,23)