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N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-2-butanoyl-6-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-2-butanoyl-6-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name:N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-2-butanoyl-6-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
Openeye Name:N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-butanoyl-6-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxamide
CAS Name:N-[3-[4-(3-aminopropylamino)butylamino]propyl]-6-hydroxy-2-(1-oxobutyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide
IUPAC Name:N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-butanoyl-6-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxamide
Traditional Name:N-[3-[4-(3-aminopropylamino)butylamino]propyl]-2-butyryl-6-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxamide
Formula: C24H41N5O3
MolecularWeight: 447.61404
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CC2=C(CC1C(=O)NCCCNCCCCNCCCN)C=C(C=C2)O


Isomeric SMILES

CCCC(=O)N1CC2=C(CC1C(=O)NCCCNCCCCNCCCN)C=C(C=C2)O


InChI

InChI=1S/C24H41N5O3/c1-2-7-23(31)29-18-19-8-9-21(30)16-20(19)17-22(29)24(32)28-15-6-14-27-12-4-3-11-26-13-5-10-25/h8-9,16,22,26-27,30H,2-7,10-15,17-18,25H2,1H3,(H,28,32)


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