2-[2-[4-[(3S)-1-ethanimidoylpyrrolidin-3-yl]oxyphenyl]ethyl]-1-benzofuran-5-carboximidamide dichloride

Systemtic Name: 2-[2-[4-[(3S)-1-ethanimidoylpyrrolidin-3-yl]oxyphenyl]ethyl]-1-benzofuran-5-carboximidamide dichloride Openeye Name: 2-[2-[4-[(3S)-1-ethanimidoylpyrrolidin-3-yl]oxyphenyl]ethyl]benzofuran-5-carboxamidine dichloride CAS Name: 2-[2-[4-[[(3S)-1-(1-iminoethyl)-3-pyrrolidinyl]oxy]phenyl]ethyl]-5-benzofurancarboximidamide dichloride IUPAC Name: 2-[2-[4-[(3S)-1-ethanimidoylpyrrolidin-3-yl]oxyphenyl]ethyl]-1-benzofuran-5-carboximidamide dichloride Traditional Name: 2-[2-[4-[(3S)-1-acetimidoylpyrrolidin-3-yl]oxyphenyl]ethyl]benzofuran-5-carboxamidine dichloride Formula: C23H26Cl2N4O2-2 MolecularWeight: 461.38414

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(C1)OC2=CC=C(C=C2)CCC3=CC4=C(O3)C=CC(=C4)C(=N)N.[Cl-].[Cl-]

Isomeric SMILES

CC(=N)N1CC[C@@H](C1)OC2=CC=C(C=C2)CCC3=CC4=C(O3)C=CC(=C4)C(=N)N.[Cl-].[Cl-]

InChI

InChI=1S/C23H26N4O2.2ClH/c1-15(24)27-11-10-21(14-27)28-19-6-2-16(3-7-19)4-8-20-13-18-12-17(23(25)26)5-9-22(18)29-20;;/h2-3,5-7,9,12-13,21,24H,4,8,10-11,14H2,1H3,(H3,25,26);2*1H/p-2/t21-;;/m0../s1