N,N-diethyl-4-[4-[6-[(phenylmethyl)amino]hexoxy]but-1-ynyl]benzamide

Systemtic Name: N,N-diethyl-4-[4-[6-[(phenylmethyl)amino]hexoxy]but-1-ynyl]benzamide Openeye Name: 4-[4-[6-(benzylamino)hexoxy]but-1-ynyl]-N,N-diethyl-benzamide CAS Name: N,N-diethyl-4-[4-[6-[(phenylmethyl)amino]hexoxy]but-1-ynyl]benzamide IUPAC Name: 4-[4-[6-(benzylamino)hexoxy]but-1-ynyl]-N,N-diethylbenzamide Traditional Name: 4-[4-[6-(benzylamino)hexoxy]but-1-ynyl]-N,N-diethyl-benzamide Formula: C28H38N2O2 MolecularWeight: 434.61352

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C#CCCOCCCCCCNCC2=CC=CC=C2

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C#CCCOCCCCCCNCC2=CC=CC=C2

InChI

InChI=1S/C28H38N2O2/c1-3-30(4-2)28(31)27-19-17-25(18-20-27)14-10-13-23-32-22-12-6-5-11-21-29-24-26-15-8-7-9-16-26/h7-9,15-20,29H,3-6,11-13,21-24H2,1-2H3