tert-butyl N-[3-[(2S)-2-butyl-4-naphthalen-1-ylcarbonyl-piperazin-1-yl]-2-(naphthalen-2-ylmethylamino)propyl]carbamate

Systemtic Name: tert-butyl N-[3-[(2S)-2-butyl-4-naphthalen-1-ylcarbonyl-piperazin-1-yl]-2-(naphthalen-2-ylmethylamino)propyl]carbamate Openeye Name: tert-butyl N-[3-[(2S)-2-butyl-4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-(2-naphthylmethylamino)propyl]carbamate CAS Name: N-[3-[(2S)-2-butyl-4-[1-naphthalenyl(oxo)methyl]-1-piperazinyl]-2-(2-naphthalenylmethylamino)propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[(2S)-2-butyl-4-(naphthalene-1-carbonyl)piperazin-1-yl]-2-(naphthalen-2-ylmethylamino)propyl]carbamate Traditional Name: N-[3-[(2S)-2-butyl-4-(1-naphthoyl)piperazino]-2-(2-naphthylmethylamino)propyl]carbamic acid tert-butyl ester Formula: C38H48N4O3 MolecularWeight: 608.81272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CCN1CC(CNC(=O)OC(C)(C)C)NCC2=CC3=CC=CC=C3C=C2)C(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCCC[C@H]1CN(CCN1CC(CNC(=O)OC(C)(C)C)NCC2=CC3=CC=CC=C3C=C2)C(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C38H48N4O3/c1-5-6-16-33-27-42(36(43)35-18-11-15-30-13-9-10-17-34(30)35)22-21-41(33)26-32(25-40-37(44)45-38(2,3)4)39-24-28-19-20-29-12-7-8-14-31(29)23-28/h7-15,17-20,23,32-33,39H,5-6,16,21-22,24-27H2,1-4H3,(H,40,44)/t32?,33-/m0/s1