[4-acetyloxy-5-(4-bromophenyl)sulfinyl-2,3-dimethoxy-naphthalen-1-yl] 2-methoxybenzoate

Systemtic Name: [4-acetyloxy-5-(4-bromophenyl)sulfinyl-2,3-dimethoxy-naphthalen-1-yl] 2-methoxybenzoate Openeye Name: [4-acetoxy-5-(4-bromophenyl)sulfinyl-2,3-dimethoxy-1-naphthyl] 2-methoxybenzoate CAS Name: 2-methoxybenzoic acid [4-acetyloxy-5-(4-bromophenyl)sulfinyl-2,3-dimethoxy-1-naphthalenyl] ester IUPAC Name: [4-acetyloxy-5-(4-bromophenyl)sulfinyl-2,3-dimethoxynaphthalen-1-yl] 2-methoxybenzoate Traditional Name: 2-methoxybenzoic acid [4-acetoxy-5-(4-bromophenyl)sulfinyl-2,3-dimethoxy-1-naphthyl] ester Formula: C28H23BrO8S MolecularWeight: 599.44642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=C(C2=C1C(=CC=C2)S(=O)C3=CC=C(C=C3)Br)OC(=O)C4=CC=CC=C4OC)OC)OC

Isomeric SMILES

CC(=O)OC1=C(C(=C(C2=C1C(=CC=C2)S(=O)C3=CC=C(C=C3)Br)OC(=O)C4=CC=CC=C4OC)OC)OC

InChI

InChI=1S/C28H23BrO8S/c1-16(30)36-25-23-20(9-7-11-22(23)38(32)18-14-12-17(29)13-15-18)24(26(34-3)27(25)35-4)37-28(31)19-8-5-6-10-21(19)33-2/h5-15H,1-4H3