ditert-butyl 3-[3-[(4-chlorophenyl)methylcarbamoyl]-1-cyclopropyl-4-oxidanylidene-quinolin-6-yl]propyl phosphate

Systemtic Name: ditert-butyl 3-[3-[(4-chlorophenyl)methylcarbamoyl]-1-cyclopropyl-4-oxidanylidene-quinolin-6-yl]propyl phosphate Openeye Name: ditert-butyl 3-[3-[(4-chlorophenyl)methylcarbamoyl]-1-cyclopropyl-4-oxo-6-quinolyl]propyl phosphate CAS Name: phosphoric acid ditert-butyl 3-[3-[[(4-chlorophenyl)methylamino]-oxomethyl]-1-cyclopropyl-4-oxo-6-quinolinyl]propyl ester IUPAC Name: ditert-butyl 3-[3-[(4-chlorophenyl)methylcarbamoyl]-1-cyclopropyl-4-oxoquinolin-6-yl]propyl phosphate Traditional Name: phosphoric acid ditert-butyl 3-[3-[(4-chlorobenzyl)carbamoyl]-1-cyclopropyl-4-keto-6-quinolyl]propyl ester Formula: C31H40ClN2O6P MolecularWeight: 603.085861

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OP(=O)(OCCCC1=CC2=C(C=C1)N(C=C(C2=O)C(=O)NCC3=CC=C(C=C3)Cl)C4CC4)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OP(=O)(OCCCC1=CC2=C(C=C1)N(C=C(C2=O)C(=O)NCC3=CC=C(C=C3)Cl)C4CC4)OC(C)(C)C

InChI

InChI=1S/C31H40ClN2O6P/c1-30(2,3)39-41(37,40-31(4,5)6)38-17-7-8-21-11-16-27-25(18-21)28(35)26(20-34(27)24-14-15-24)29(36)33-19-22-9-12-23(32)13-10-22/h9-13,16,18,20,24H,7-8,14-15,17,19H2,1-6H3,(H,33,36)