tert-butyl N-[[3-[2-(4-azanylbutanoylamino)phenoxy]phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[3-[2-(4-azanylbutanoylamino)phenoxy]phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[3-[2-(4-aminobutanoylamino)phenoxy]phenyl]methyl]carbamate CAS Name: N-[[3-[2-[(4-amino-1-oxobutyl)amino]phenoxy]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[3-[2-(4-aminobutanoylamino)phenoxy]phenyl]methyl]carbamate Traditional Name: N-[3-[2-(4-aminobutanoylamino)phenoxy]benzyl]carbamic acid tert-butyl ester Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC(=CC=C1)OC2=CC=CC=C2NC(=O)CCCN

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC(=CC=C1)OC2=CC=CC=C2NC(=O)CCCN

InChI

InChI=1S/C22H29N3O4/c1-22(2,3)29-21(27)24-15-16-8-6-9-17(14-16)28-19-11-5-4-10-18(19)25-20(26)12-7-13-23/h4-6,8-11,14H,7,12-13,15,23H2,1-3H3,(H,24,27)(H,25,26)