N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-1-butanoyl-4-phenyl-piperidine-4-carboxamide

Systemtic Name: N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-1-butanoyl-4-phenyl-piperidine-4-carboxamide Openeye Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-1-butanoyl-4-phenyl-piperidine-4-carboxamide CAS Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-1-(1-oxobutyl)-4-phenyl-4-piperidinecarboxamide IUPAC Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-1-butanoyl-4-phenylpiperidine-4-carboxamide Traditional Name: N-[3-[4-(3-aminopropylamino)butylamino]propyl]-1-butyryl-4-phenyl-isonipecotamide Formula: C26H45N5O2 MolecularWeight: 459.6678

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)NCCCNCCCCNCCCN

Isomeric SMILES

CCCC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)NCCCNCCCCNCCCN

InChI

InChI=1S/C26H45N5O2/c1-2-10-24(32)31-21-13-26(14-22-31,23-11-4-3-5-12-23)25(33)30-20-9-19-29-17-7-6-16-28-18-8-15-27/h3-5,11-12,28-29H,2,6-10,13-22,27H2,1H3,(H,30,33)