(2R)-N-(2-azanylethyl)-1-ethanoyl-4-[(4-methylphenyl)methyl-phenethyl-amino]piperidine-2-carboxamide

Systemtic Name: (2R)-N-(2-azanylethyl)-1-ethanoyl-4-[(4-methylphenyl)methyl-phenethyl-amino]piperidine-2-carboxamide Openeye Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[phenethyl(p-tolylmethyl)amino]piperidine-2-carboxamide CAS Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[(4-methylphenyl)methyl-phenethylamino]-2-piperidinecarboxamide IUPAC Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[(4-methylphenyl)methyl-phenethylamino]piperidine-2-carboxamide Traditional Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[(4-methylbenzyl)-phenethyl-amino]pipecolinamide Formula: C26H36N4O2 MolecularWeight: 436.58964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CCN(C(C3)C(=O)NCCN)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CCN([C@H](C3)C(=O)NCCN)C(=O)C

InChI

InChI=1S/C26H36N4O2/c1-20-8-10-23(11-9-20)19-29(16-12-22-6-4-3-5-7-22)24-13-17-30(21(2)31)25(18-24)26(32)28-15-14-27/h3-11,24-25H,12-19,27H2,1-2H3,(H,28,32)/t24?,25-/m1/s1