[(2R)-2,3-dihydro-1-benzofuran-2-yl]-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [(2R)-2,3-dihydro-1-benzofuran-2-yl]-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: [(2R)-2,3-dihydrobenzofuran-2-yl]-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: [(2R)-2,3-dihydrobenzofuran-2-yl]-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: [(2R)-2,3-dihydro-1-benzofuran-2-yl]-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: [(2R)-coumaran-2-yl]-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]methanone Formula: C24H25N2O2+ MolecularWeight: 373.4675

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)C4CC5=CC=CC=C5O4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)[C@H]4CC5=CC=CC=C5O4

InChI

InChI=1S/C24H24N2O2/c27-24(23-16-19-7-2-4-11-22(19)28-23)26-14-12-25(13-15-26)17-20-9-5-8-18-6-1-3-10-21(18)20/h1-11,23H,12-17H2/p+1/t23-/m1/s1