tert-butyl 2-[1-(naphthalen-1-ylcarbamoyloxy)ethylcarbamoyloxy]propanoate; 2-fluoranylaniline

Systemtic Name: tert-butyl 2-[1-(naphthalen-1-ylcarbamoyloxy)ethylcarbamoyloxy]propanoate; 2-fluoranylaniline Openeye Name: tert-butyl 2-[1-(1-naphthylcarbamoyloxy)ethylcarbamoyloxy]propanoate; 2-fluoroaniline CAS Name: 2-fluoroaniline; 2-[[1-[(1-naphthalenylamino)-oxomethoxy]ethylamino]-oxomethoxy]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[1-(naphthalen-1-ylcarbamoyloxy)ethylcarbamoyloxy]propanoate; 2-fluoroaniline Traditional Name: (2-fluorophenyl)amine; 2-[1-(1-naphthylcarbamoyloxy)ethylcarbamoyloxy]propionic acid tert-butyl ester Formula: C27H32FN3O6 MolecularWeight: 513.557883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)(C)C)OC(=O)NC(C)OC(=O)NC1=CC=CC2=CC=CC=C21.C1=CC=C(C(=C1)N)F

Isomeric SMILES

CC(C(=O)OC(C)(C)C)OC(=O)NC(C)OC(=O)NC1=CC=CC2=CC=CC=C21.C1=CC=C(C(=C1)N)F

InChI

InChI=1S/C21H26N2O6.C6H6FN/c1-13(18(24)29-21(3,4)5)27-19(25)22-14(2)28-20(26)23-17-12-8-10-15-9-6-7-11-16(15)17;7-5-3-1-2-4-6(5)8/h6-14H,1-5H3,(H,22,25)(H,23,26);1-4H,8H2