tert-butyl N-[2-oxidanylidene-2-[5-phenyl-4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-oxidanylidene-2-[5-phenyl-4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]carbamate Openeye Name: tert-butyl N-[2-(4-benzyl-5-phenyl-1,4-diazepan-1-yl)-2-oxo-ethyl]carbamate CAS Name: N-[2-oxo-2-[5-phenyl-4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-(4-benzyl-5-phenyl-1,4-diazepan-1-yl)-2-oxoethyl]carbamate Traditional Name: N-[2-(4-benzyl-5-phenyl-1,4-diazepan-1-yl)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C25H33N3O3 MolecularWeight: 423.54782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(=O)N1CCC(N(CC1)CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NCC(=O)N1CCC(N(CC1)CC2=CC=CC=C2)C3=CC=CC=C3

InChI

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