tert-butyl N-[4-[[1-(2-azanyl-3-phenyl-propanoyl)pyrrolidin-2-yl]carbonylamino]butyl]carbamate

Systemtic Name: tert-butyl N-[4-[[1-(2-azanyl-3-phenyl-propanoyl)pyrrolidin-2-yl]carbonylamino]butyl]carbamate Openeye Name: tert-butyl N-[4-[[1-(2-amino-3-phenyl-propanoyl)pyrrolidine-2-carbonyl]amino]butyl]carbamate CAS Name: N-[4-[[[1-(2-amino-1-oxo-3-phenylpropyl)-2-pyrrolidinyl]-oxomethyl]amino]butyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[[1-(2-amino-3-phenylpropanoyl)pyrrolidine-2-carbonyl]amino]butyl]carbamate Traditional Name: N-[4-[(1-phenylalanylprolyl)amino]butyl]carbamic acid tert-butyl ester Formula: C23H36N4O4 MolecularWeight: 432.55634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCNC(=O)C1CCCN1C(=O)C(CC2=CC=CC=C2)N

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCNC(=O)C1CCCN1C(=O)C(CC2=CC=CC=C2)N

InChI

InChI=1S/C23H36N4O4/c1-23(2,3)31-22(30)26-14-8-7-13-25-20(28)19-12-9-15-27(19)21(29)18(24)16-17-10-5-4-6-11-17/h4-6,10-11,18-19H,7-9,12-16,24H2,1-3H3,(H,25,28)(H,26,30)