tert-butyl 2-(2-hydroxyethyl)-4-[1-(methylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-3-oxidanylidene-piperazine-1-carboxylate

Systemtic Name: tert-butyl 2-(2-hydroxyethyl)-4-[1-(methylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-3-oxidanylidene-piperazine-1-carboxylate Openeye Name: tert-butyl 2-(2-hydroxyethyl)-4-[2-(methylamino)-1-(2-naphthylmethyl)-2-oxo-ethyl]-3-oxo-piperazine-1-carboxylate CAS Name: 2-(2-hydroxyethyl)-4-[1-(methylamino)-3-(2-naphthalenyl)-1-oxopropan-2-yl]-3-oxo-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(2-hydroxyethyl)-4-[1-(methylamino)-3-naphthalen-2-yl-1-oxopropan-2-yl]-3-oxopiperazine-1-carboxylate Traditional Name: 2-(2-hydroxyethyl)-3-keto-4-[2-keto-2-(methylamino)-1-(2-naphthylmethyl)ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C25H33N3O5 MolecularWeight: 455.54662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C(=O)C1CCO)C(CC2=CC3=CC=CC=C3C=C2)C(=O)NC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C(=O)C1CCO)C(CC2=CC3=CC=CC=C3C=C2)C(=O)NC

InChI

InChI=1S/C25H33N3O5/c1-25(2,3)33-24(32)28-13-12-27(23(31)20(28)11-14-29)21(22(30)26-4)16-17-9-10-18-7-5-6-8-19(18)15-17/h5-10,15,20-21,29H,11-14,16H2,1-4H3,(H,26,30)