1-[(S)-(2-methoxynaphthalen-1-yl)sulfinyl]-4-(phenylmethyl)piperazin-4-ium

Systemtic Name: 1-[(S)-(2-methoxynaphthalen-1-yl)sulfinyl]-4-(phenylmethyl)piperazin-4-ium Openeye Name: 1-benzyl-4-[(S)-(2-methoxy-1-naphthyl)sulfinyl]piperazin-1-ium CAS Name: 1-[(S)-(2-methoxy-1-naphthalenyl)sulfinyl]-4-(phenylmethyl)piperazin-4-ium IUPAC Name: 1-benzyl-4-[(S)-(2-methoxynaphthalen-1-yl)sulfinyl]piperazin-1-ium Traditional Name: 1-benzyl-4-[(S)-(2-methoxy-1-naphthyl)sulfinyl]piperazin-1-ium Formula: C22H25N2O2S+ MolecularWeight: 381.5111

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1)S(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1)[S@](=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H24N2O2S/c1-26-21-12-11-19-9-5-6-10-20(19)22(21)27(25)24-15-13-23(14-16-24)17-18-7-3-2-4-8-18/h2-12H,13-17H2,1H3/p+1/t27-/m0/s1