tert-butyl N-[2-oxidanyl-3-[4-(prop-2-ynoxycarbonylamino)phenoxy]propyl]-N-propan-2-yl-carbamate

Systemtic Name: tert-butyl N-[2-oxidanyl-3-[4-(prop-2-ynoxycarbonylamino)phenoxy]propyl]-N-propan-2-yl-carbamate Openeye Name: tert-butyl N-[2-hydroxy-3-[4-(prop-2-ynoxycarbonylamino)phenoxy]propyl]-N-isopropyl-carbamate CAS Name: N-[2-hydroxy-3-[4-[[oxo(prop-2-ynoxy)methyl]amino]phenoxy]propyl]-N-propan-2-ylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-hydroxy-3-[4-(prop-2-ynoxycarbonylamino)phenoxy]propyl]-N-propan-2-ylcarbamate Traditional Name: N-[2-hydroxy-3-[4-(propargyloxycarbonylamino)phenoxy]propyl]-N-isopropyl-carbamic acid tert-butyl ester Formula: C21H30N2O6 MolecularWeight: 406.4727

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(COC1=CC=C(C=C1)NC(=O)OCC#C)O)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)N(CC(COC1=CC=C(C=C1)NC(=O)OCC#C)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H30N2O6/c1-7-12-27-19(25)22-16-8-10-18(11-9-16)28-14-17(24)13-23(15(2)3)20(26)29-21(4,5)6/h1,8-11,15,17,24H,12-14H2,2-6H3,(H,22,25)