2-(4-bromophenyl)sulfonylethyl-[(R)-(4-methoxyphenyl)-phenyl-methyl]azanium

Systemtic Name: 2-(4-bromophenyl)sulfonylethyl-[(R)-(4-methoxyphenyl)-phenyl-methyl]azanium Openeye Name: 2-(4-bromophenyl)sulfonylethyl-[(R)-(4-methoxyphenyl)-phenyl-methyl]ammonium CAS Name: 2-(4-bromophenyl)sulfonylethyl-[(R)-(4-methoxyphenyl)-phenylmethyl]ammonium IUPAC Name: 2-(4-bromophenyl)sulfonylethyl-[(R)-(4-methoxyphenyl)-phenylmethyl]azanium Traditional Name: 2-brosylethyl-[(R)-(4-methoxyphenyl)-phenyl-methyl]ammonium Formula: C22H23BrNO3S+ MolecularWeight: 461.39192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)[NH2+]CCS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H](C2=CC=CC=C2)[NH2+]CCS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H22BrNO3S/c1-27-20-11-7-18(8-12-20)22(17-5-3-2-4-6-17)24-15-16-28(25,26)21-13-9-19(23)10-14-21/h2-14,22,24H,15-16H2,1H3/p+1/t22-/m1/s1