tert-butyl N-[[4-[[2-(pyrrolidin-1-ylmethyl)phenyl]methylcarbamoyl]phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[[2-(pyrrolidin-1-ylmethyl)phenyl]methylcarbamoyl]phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[[2-(pyrrolidin-1-ylmethyl)phenyl]methylcarbamoyl]phenyl]methyl]carbamate CAS Name: N-[[4-[oxo-[[2-(1-pyrrolidinylmethyl)phenyl]methylamino]methyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[[2-(pyrrolidin-1-ylmethyl)phenyl]methylcarbamoyl]phenyl]methyl]carbamate Traditional Name: N-[4-[[2-(pyrrolidinomethyl)benzyl]carbamoyl]benzyl]carbamic acid tert-butyl ester Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)NCC2=CC=CC=C2CN3CCCC3

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)NCC2=CC=CC=C2CN3CCCC3

InChI

InChI=1S/C25H33N3O3/c1-25(2,3)31-24(30)27-16-19-10-12-20(13-11-19)23(29)26-17-21-8-4-5-9-22(21)18-28-14-6-7-15-28/h4-5,8-13H,6-7,14-18H2,1-3H3,(H,26,29)(H,27,30)