tert-butyl (NZ)-N-[azanyl-[3-(2-azanyl-2-oxidanylidene-ethyl)-2,3-dihydro-1-benzofuran-5-yl]methylidene]carbamate

Systemtic Name: tert-butyl (NZ)-N-[azanyl-[3-(2-azanyl-2-oxidanylidene-ethyl)-2,3-dihydro-1-benzofuran-5-yl]methylidene]carbamate Openeye Name: tert-butyl (NZ)-N-[amino-[3-(2-amino-2-oxo-ethyl)-2,3-dihydrobenzofuran-5-yl]methylene]carbamate CAS Name: (NZ)-N-[amino-[3-(2-amino-2-oxoethyl)-2,3-dihydrobenzofuran-5-yl]methylidene]carbamic acid tert-butyl ester IUPAC Name: tert-butyl (NZ)-N-[amino-[3-(2-amino-2-oxoethyl)-2,3-dihydro-1-benzofuran-5-yl]methylidene]carbamate Traditional Name: (NZ)-N-[amino-[3-(2-amino-2-keto-ethyl)coumaran-5-yl]methylene]carbamic acid tert-butyl ester Formula: C16H21N3O4 MolecularWeight: 319.35564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N=C(C1=CC2=C(C=C1)OCC2CC(=O)N)N

Isomeric SMILES

CC(C)(C)OC(=O)/N=C(/C1=CC2=C(C=C1)OCC2CC(=O)N)\N

InChI

InChI=1S/C16H21N3O4/c1-16(2,3)23-15(21)19-14(18)9-4-5-12-11(6-9)10(8-22-12)7-13(17)20/h4-6,10H,7-8H2,1-3H3,(H2,17,20)(H2,18,19,21)