tert-butyl N-[2-methoxy-5-[2-[(phenylmethyl)carbamoylamino]ethanoylamino]phenyl]carbamate

Systemtic Name: tert-butyl N-[2-methoxy-5-[2-[(phenylmethyl)carbamoylamino]ethanoylamino]phenyl]carbamate Openeye Name: tert-butyl N-[5-[[2-(benzylcarbamoylamino)acetyl]amino]-2-methoxy-phenyl]carbamate CAS Name: N-[2-methoxy-5-[[1-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl]amino]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-[[2-(benzylcarbamoylamino)acetyl]amino]-2-methoxyphenyl]carbamate Traditional Name: N-[5-[[2-(benzylcarbamoylamino)acetyl]amino]-2-methoxy-phenyl]carbamic acid tert-butyl ester Formula: C22H28N4O5 MolecularWeight: 428.48152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=CC(=C1)NC(=O)CNC(=O)NCC2=CC=CC=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=CC(=C1)NC(=O)CNC(=O)NCC2=CC=CC=C2)OC

InChI

InChI=1S/C22H28N4O5/c1-22(2,3)31-21(29)26-17-12-16(10-11-18(17)30-4)25-19(27)14-24-20(28)23-13-15-8-6-5-7-9-15/h5-12H,13-14H2,1-4H3,(H,25,27)(H,26,29)(H2,23,24,28)