cyclohexyl-[(2S)-3-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]-2-oxidanyl-propyl]-(phenylmethyl)azanium

Systemtic Name: cyclohexyl-[(2S)-3-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]-2-oxidanyl-propyl]-(phenylmethyl)azanium Openeye Name: benzyl-cyclohexyl-[(2S)-2-hydroxy-3-[2-(1-naphthylmethyl)benzimidazol-1-yl]propyl]ammonium CAS Name: cyclohexyl-[(2S)-2-hydroxy-3-[2-(1-naphthalenylmethyl)-1-benzimidazolyl]propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-cyclohexyl-[(2S)-2-hydroxy-3-[2-(naphthalen-1-ylmethyl)benzimidazol-1-yl]propyl]azanium Traditional Name: benzyl-cyclohexyl-[(2S)-2-hydroxy-3-[2-(1-naphthylmethyl)benzimidazol-1-yl]propyl]ammonium Formula: C34H38N3O+ MolecularWeight: 504.68502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+](CC2=CC=CC=C2)CC(CN3C4=CC=CC=C4N=C3CC5=CC=CC6=CC=CC=C65)O

Isomeric SMILES

C1CCC(CC1)[NH+](CC2=CC=CC=C2)C[C@H](CN3C4=CC=CC=C4N=C3CC5=CC=CC6=CC=CC=C65)O

InChI

InChI=1S/C34H37N3O/c38-30(24-36(29-17-5-2-6-18-29)23-26-12-3-1-4-13-26)25-37-33-21-10-9-20-32(33)35-34(37)22-28-16-11-15-27-14-7-8-19-31(27)28/h1,3-4,7-16,19-21,29-30,38H,2,5-6,17-18,22-25H2/p+1/t30-/m1/s1