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

Systemtic Name: 4-[(R)-[3-[(4-tert-butylphenyl)methylamino]phenyl]-piperazin-1-yl-methyl]-N,N-diethyl-benzamide Openeye Name: 4-[(R)-[3-[(4-tert-butylphenyl)methylamino]phenyl]-piperazin-1-yl-methyl]-N,N-diethyl-benzamide CAS Name: 4-[(R)-[3-[(4-tert-butylphenyl)methylamino]phenyl]-(1-piperazinyl)methyl]-N,N-diethylbenzamide IUPAC Name: 4-[(R)-[3-[(4-tert-butylphenyl)methylamino]phenyl]-piperazin-1-ylmethyl]-N,N-diethylbenzamide Traditional Name: 4-[(R)-[3-[(4-tert-butylbenzyl)amino]phenyl]-piperazino-methyl]-N,N-diethyl-benzamide Formula: C33H44N4O MolecularWeight: 512.72866

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC(=CC=C2)NCC3=CC=C(C=C3)C(C)(C)C)N4CCNCC4

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)[C@H](C2=CC(=CC=C2)NCC3=CC=C(C=C3)C(C)(C)C)N4CCNCC4

InChI

InChI=1S/C33H44N4O/c1-6-36(7-2)32(38)27-15-13-26(14-16-27)31(37-21-19-34-20-22-37)28-9-8-10-30(23-28)35-24-25-11-17-29(18-12-25)33(3,4)5/h8-18,23,31,34-35H,6-7,19-22,24H2,1-5H3/t31-/m1/s1