[4-(2-chlorophenyl)-3,5-bis(ethoxycarbonyl)-6-methyl-1,4-dihydropyridin-2-yl]methyl-triphenyl-phosphanium

Systemtic Name: [4-(2-chlorophenyl)-3,5-bis(ethoxycarbonyl)-6-methyl-1,4-dihydropyridin-2-yl]methyl-triphenyl-phosphanium Openeye Name: [4-(2-chlorophenyl)-3,5-bis(ethoxycarbonyl)-6-methyl-1,4-dihydropyridin-2-yl]methyl-triphenyl-phosphonium CAS Name: [4-(2-chlorophenyl)-3,5-bis(ethoxycarbonyl)-6-methyl-1,4-dihydropyridin-2-yl]methyl-triphenylphosphonium IUPAC Name: [4-(2-chlorophenyl)-3,5-bis(ethoxycarbonyl)-6-methyl-1,4-dihydropyridin-2-yl]methyl-triphenylphosphanium Traditional Name: [3,5-dicarbethoxy-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridin-2-yl]methyl-triphenyl-phosphonium Formula: C37H36ClNO4P+ MolecularWeight: 625.112801

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OCC)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OCC)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C37H35ClNO4P/c1-4-42-36(40)33-26(3)39-32(35(37(41)43-5-2)34(33)30-23-15-16-24-31(30)38)25-44(27-17-9-6-10-18-27,28-19-11-7-12-20-28)29-21-13-8-14-22-29/h6-24,34H,4-5,25H2,1-3H3/p+1