[4-chloranyl-5-methoxy-2-(2-methoxy-4-methoxycarbonyl-phenyl)phenyl]methyl-triphenyl-phosphanium

Systemtic Name: [4-chloranyl-5-methoxy-2-(2-methoxy-4-methoxycarbonyl-phenyl)phenyl]methyl-triphenyl-phosphanium Openeye Name: [4-chloro-5-methoxy-2-(2-methoxy-4-methoxycarbonyl-phenyl)phenyl]methyl-triphenyl-phosphonium CAS Name: [4-chloro-5-methoxy-2-(2-methoxy-4-methoxycarbonylphenyl)phenyl]methyl-triphenylphosphonium IUPAC Name: [4-chloro-5-methoxy-2-(2-methoxy-4-methoxycarbonylphenyl)phenyl]methyl-triphenylphosphanium Traditional Name: [2-(4-carbomethoxy-2-methoxy-phenyl)-4-chloro-5-methoxy-benzyl]-triphenyl-phosphonium Formula: C35H31ClO4P+ MolecularWeight: 582.045001

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)C2=CC(=C(C=C2C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)OC)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)C2=CC(=C(C=C2C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)OC)Cl

InChI

InChI=1S/C35H31ClO4P/c1-38-33-21-25(35(37)40-3)19-20-30(33)31-23-32(36)34(39-2)22-26(31)24-41(27-13-7-4-8-14-27,28-15-9-5-10-16-28)29-17-11-6-12-18-29/h4-23H,24H2,1-3H3/q+1