N-[4-[[2-(dibutylamino)ethyl-(4-pentylphenyl)carbonyl-amino]methyl]phenyl]piperidine-3-carboxamide

Systemtic Name: N-[4-[[2-(dibutylamino)ethyl-(4-pentylphenyl)carbonyl-amino]methyl]phenyl]piperidine-3-carboxamide Openeye Name: N-[4-[[2-(dibutylamino)ethyl-(4-pentylbenzoyl)amino]methyl]phenyl]piperidine-3-carboxamide CAS Name: N-[4-[[2-(dibutylamino)ethyl-[oxo-(4-pentylphenyl)methyl]amino]methyl]phenyl]-3-piperidinecarboxamide IUPAC Name: N-[4-[[2-(dibutylamino)ethyl-(4-pentylbenzoyl)amino]methyl]phenyl]piperidine-3-carboxamide Traditional Name: N-[4-[[(4-amylbenzoyl)-[2-(dibutylamino)ethyl]amino]methyl]phenyl]nipecotamide Formula: C35H54N4O2 MolecularWeight: 562.82886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CCN(CCCC)CCCC)CC2=CC=C(C=C2)NC(=O)C3CCCNC3

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CCN(CCCC)CCCC)CC2=CC=C(C=C2)NC(=O)C3CCCNC3

InChI

InChI=1S/C35H54N4O2/c1-4-7-10-12-29-14-18-31(19-15-29)35(41)39(26-25-38(23-8-5-2)24-9-6-3)28-30-16-20-33(21-17-30)37-34(40)32-13-11-22-36-27-32/h14-21,32,36H,4-13,22-28H2,1-3H3,(H,37,40)