2-(isoquinolin-1-ylcarbonylamino)-N-(1-oxidanyl-4-phenyl-butyl)butanediamide

Systemtic Name: 2-(isoquinolin-1-ylcarbonylamino)-N-(1-oxidanyl-4-phenyl-butyl)butanediamide Openeye Name: N-(1-hydroxy-4-phenyl-butyl)-2-(isoquinoline-1-carbonylamino)butanediamide CAS Name: N-(1-hydroxy-4-phenylbutyl)-2-[[1-isoquinolinyl(oxo)methyl]amino]butanediamide IUPAC Name: N-(1-hydroxy-4-phenylbutyl)-2-(isoquinoline-1-carbonylamino)butanediamide Traditional Name: N-(1-hydroxy-4-phenyl-butyl)-2-(isoquinoline-1-carbonylamino)succinamide Formula: C24H26N4O4 MolecularWeight: 434.48764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(NC(=O)C(CC(=O)N)NC(=O)C2=NC=CC3=CC=CC=C32)O

Isomeric SMILES

C1=CC=C(C=C1)CCCC(NC(=O)C(CC(=O)N)NC(=O)C2=NC=CC3=CC=CC=C32)O

InChI

InChI=1S/C24H26N4O4/c25-20(29)15-19(23(31)28-21(30)12-6-9-16-7-2-1-3-8-16)27-24(32)22-18-11-5-4-10-17(18)13-14-26-22/h1-5,7-8,10-11,13-14,19,21,30H,6,9,12,15H2,(H2,25,29)(H,27,32)(H,28,31)