4-[(R)-[3-(cyclononylamino)phenyl]-piperazin-1-yl-methyl]-N,N-diethyl-benzamide

Systemtic Name: 4-[(R)-[3-(cyclononylamino)phenyl]-piperazin-1-yl-methyl]-N,N-diethyl-benzamide Openeye Name: 4-[(R)-[3-(cyclononylamino)phenyl]-piperazin-1-yl-methyl]-N,N-diethyl-benzamide CAS Name: 4-[(R)-[3-(cyclononylamino)phenyl]-(1-piperazinyl)methyl]-N,N-diethylbenzamide IUPAC Name: 4-[(R)-[3-(cyclononylamino)phenyl]-piperazin-1-ylmethyl]-N,N-diethylbenzamide Traditional Name: 4-[(R)-[3-(cyclononylamino)phenyl]-piperazino-methyl]-N,N-diethyl-benzamide Formula: C31H46N4O MolecularWeight: 490.72314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC(=CC=C2)NC3CCCCCCCC3)N4CCNCC4

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)[C@H](C2=CC(=CC=C2)NC3CCCCCCCC3)N4CCNCC4

InChI

InChI=1S/C31H46N4O/c1-3-34(4-2)31(36)26-18-16-25(17-19-26)30(35-22-20-32-21-23-35)27-12-11-15-29(24-27)33-28-13-9-7-5-6-8-10-14-28/h11-12,15-19,24,28,30,32-33H,3-10,13-14,20-23H2,1-2H3/t30-/m1/s1