3-[3-[(4-chlorophenyl)methylcarbamoyl]-4-oxidanylidene-1H-quinolin-6-yl]propyl dihydrogen phosphate

Systemtic Name: 3-[3-[(4-chlorophenyl)methylcarbamoyl]-4-oxidanylidene-1H-quinolin-6-yl]propyl dihydrogen phosphate Openeye Name: 3-[3-[(4-chlorophenyl)methylcarbamoyl]-4-oxo-1H-quinolin-6-yl]propyl dihydrogen phosphate CAS Name: 3-[3-[[(4-chlorophenyl)methylamino]-oxomethyl]-4-oxo-1H-quinolin-6-yl]propyl dihydrogen phosphate IUPAC Name: 3-[3-[(4-chlorophenyl)methylcarbamoyl]-4-oxo-1H-quinolin-6-yl]propyl dihydrogen phosphate Traditional Name: 3-[3-[(4-chlorobenzyl)carbamoyl]-4-keto-1H-quinolin-6-yl]propyl dihydrogen phosphate Formula: C20H20ClN2O6P MolecularWeight: 450.809361

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CNC3=C(C2=O)C=C(C=C3)CCCOP(=O)(O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CNC3=C(C2=O)C=C(C=C3)CCCOP(=O)(O)O)Cl

InChI

InChI=1S/C20H20ClN2O6P/c21-15-6-3-14(4-7-15)11-23-20(25)17-12-22-18-8-5-13(10-16(18)19(17)24)2-1-9-29-30(26,27)28/h3-8,10,12H,1-2,9,11H2,(H,22,24)(H,23,25)(H2,26,27,28)