tert-butyl 4-[2-[4-[4-(2-methylpropanoylamino)phenyl]piperazin-1-yl]ethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[4-[4-(2-methylpropanoylamino)phenyl]piperazin-1-yl]ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-[4-[4-(2-methylpropanoylamino)phenyl]piperazin-1-yl]ethyl]piperidine-1-carboxylate CAS Name: 4-[2-[4-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-1-piperazinyl]ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[4-[4-(2-methylpropanoylamino)phenyl]piperazin-1-yl]ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-[4-[4-(isobutyrylamino)phenyl]piperazino]ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H42N4O3 MolecularWeight: 458.63668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)N2CCN(CC2)CCC3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)N2CCN(CC2)CCC3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H42N4O3/c1-20(2)24(31)27-22-6-8-23(9-7-22)29-18-16-28(17-19-29)13-10-21-11-14-30(15-12-21)25(32)33-26(3,4)5/h6-9,20-21H,10-19H2,1-5H3,(H,27,31)