1-ethyl-2-[2-[1-(2-oxidanyl-2-phenyl-ethanoyl)pyrrolidin-2-yl]ethyl]indole-6-carboximidamide

Systemtic Name: 1-ethyl-2-[2-[1-(2-oxidanyl-2-phenyl-ethanoyl)pyrrolidin-2-yl]ethyl]indole-6-carboximidamide Openeye Name: 1-ethyl-2-[2-[1-(2-hydroxy-2-phenyl-acetyl)pyrrolidin-2-yl]ethyl]indole-6-carboxamidine CAS Name: 1-ethyl-2-[2-[1-(2-hydroxy-1-oxo-2-phenylethyl)-2-pyrrolidinyl]ethyl]-6-indolecarboximidamide IUPAC Name: 1-ethyl-2-[2-[1-(2-hydroxy-2-phenylacetyl)pyrrolidin-2-yl]ethyl]indole-6-carboximidamide Traditional Name: 1-ethyl-2-[2-(1-mandeloylpyrrolidin-2-yl)ethyl]indole-6-carboxamidine Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3CCCN3C(=O)C(C4=CC=CC=C4)O

Isomeric SMILES

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3CCCN3C(=O)C(C4=CC=CC=C4)O

InChI

InChI=1S/C25H30N4O2/c1-2-28-21(15-18-10-11-19(24(26)27)16-22(18)28)13-12-20-9-6-14-29(20)25(31)23(30)17-7-4-3-5-8-17/h3-5,7-8,10-11,15-16,20,23,30H,2,6,9,12-14H2,1H3,(H3,26,27)