[4-[[3-[(4-tert-butylphenyl)methyl]-2-oxidanylidene-cycloheptyl]carbamoyl]phenyl] dihydrogen phosphate

Systemtic Name: [4-[[3-[(4-tert-butylphenyl)methyl]-2-oxidanylidene-cycloheptyl]carbamoyl]phenyl] dihydrogen phosphate Openeye Name: [4-[[3-[(4-tert-butylphenyl)methyl]-2-oxo-cycloheptyl]carbamoyl]phenyl] dihydrogen phosphate CAS Name: [4-[[[3-[(4-tert-butylphenyl)methyl]-2-oxocycloheptyl]amino]-oxomethyl]phenyl] dihydrogen phosphate IUPAC Name: [4-[[3-[(4-tert-butylphenyl)methyl]-2-oxocycloheptyl]carbamoyl]phenyl] dihydrogen phosphate Traditional Name: [4-[[3-(4-tert-butylbenzyl)-2-keto-cycloheptyl]carbamoyl]phenyl] dihydrogen phosphate Formula: C25H32NO6P MolecularWeight: 473.498441

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CC2CCCCC(C2=O)NC(=O)C3=CC=C(C=C3)OP(=O)(O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CC2CCCCC(C2=O)NC(=O)C3=CC=C(C=C3)OP(=O)(O)O

InChI

InChI=1S/C25H32NO6P/c1-25(2,3)20-12-8-17(9-13-20)16-19-6-4-5-7-22(23(19)27)26-24(28)18-10-14-21(15-11-18)32-33(29,30)31/h8-15,19,22H,4-7,16H2,1-3H3,(H,26,28)(H2,29,30,31)