1,4-dihydroquinoline; (2,6-dimethylphenyl) phenyl hydrogen phosphate

Systemtic Name: 1,4-dihydroquinoline; (2,6-dimethylphenyl) phenyl hydrogen phosphate Openeye Name: 1,4-dihydroquinoline; (2,6-dimethylphenyl) phenyl hydrogen phosphate CAS Name: 1,4-dihydroquinoline; (2,6-dimethylphenyl) phenyl hydrogen phosphate IUPAC Name: 1,4-dihydroquinoline; (2,6-dimethylphenyl) phenyl hydrogen phosphate Traditional Name: 1,4-dihydroquinoline; (2,6-dimethylphenyl) phenyl hydrogen phosphate Formula: C37H39NO8P2 MolecularWeight: 687.654982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OP(=O)(O)OC2=CC=CC=C2.CC1=C(C(=CC=C1)C)OP(=O)(O)OC2=CC=CC=C2.C1C=CNC2=CC=CC=C21

Isomeric SMILES

CC1=C(C(=CC=C1)C)OP(=O)(O)OC2=CC=CC=C2.CC1=C(C(=CC=C1)C)OP(=O)(O)OC2=CC=CC=C2.C1C=CNC2=CC=CC=C21

InChI

InChI=1S/2C14H15O4P.C9H9N/c2*1-11-7-6-8-12(2)14(11)18-19(15,16)17-13-9-4-3-5-10-13;1-2-6-9-8(4-1)5-3-7-10-9/h2*3-10H,1-2H3,(H,15,16);1-4,6-7,10H,5H2