N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,4-dihydronaphthalene-2-sulfonamide

Systemtic Name: N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,4-dihydronaphthalene-2-sulfonamide Openeye Name: N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,4-dihydronaphthalene-2-sulfonamide CAS Name: N-[(2R)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3,4-dihydronaphthalene-2-sulfonamide IUPAC Name: N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-3,4-dihydronaphthalene-2-sulfonamide Traditional Name: N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3,4-dihydronaphthalene-2-sulfonamide Formula: C23H29N2O3S+ MolecularWeight: 413.55296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC3=CC=CC=C3CC2)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNS(=O)(=O)C2=CC3=CC=CC=C3CC2)[NH+]4CCCC4

InChI

InChI=1S/C23H28N2O3S/c1-28-21-11-8-19(9-12-21)23(25-14-4-5-15-25)17-24-29(26,27)22-13-10-18-6-2-3-7-20(18)16-22/h2-3,6-9,11-12,16,23-24H,4-5,10,13-15,17H2,1H3/p+1/t23-/m0/s1