2-[4-[(2R,5S)-4-dodecyl-2,5-dimethyl-piperazin-1-yl]carbonylphenyl]-N'-oxidanyl-ethanimidamide

Systemtic Name: 2-[4-[(2R,5S)-4-dodecyl-2,5-dimethyl-piperazin-1-yl]carbonylphenyl]-N'-oxidanyl-ethanimidamide Openeye Name: 2-[4-[(2R,5S)-4-dodecyl-2,5-dimethyl-piperazine-1-carbonyl]phenyl]-N'-hydroxy-acetamidine CAS Name: 2-[4-[[(2R,5S)-4-dodecyl-2,5-dimethyl-1-piperazinyl]-oxomethyl]phenyl]-N'-hydroxyethanimidamide IUPAC Name: 2-[4-[(2R,5S)-4-dodecyl-2,5-dimethylpiperazine-1-carbonyl]phenyl]-N'-hydroxyethanimidamide Traditional Name: N'-hydroxy-2-[4-[(2R,5S)-4-lauryl-2,5-dimethyl-piperazine-1-carbonyl]phenyl]acetamidine Formula: C27H46N4O2 MolecularWeight: 458.67974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1CC(N(CC1C)C(=O)C2=CC=C(C=C2)CC(=NO)N)C

Isomeric SMILES

CCCCCCCCCCCCN1C[C@H](N(C[C@@H]1C)C(=O)C2=CC=C(C=C2)C/C(=N/O)/N)C

InChI

InChI=1S/C27H46N4O2/c1-4-5-6-7-8-9-10-11-12-13-18-30-20-23(3)31(21-22(30)2)27(32)25-16-14-24(15-17-25)19-26(28)29-33/h14-17,22-23,33H,4-13,18-21H2,1-3H3,(H2,28,29)/t22-,23+/m0/s1