[4-[1-ethyl-5-(5-phenylpentanoyl)pyrrol-2-yl]-2,2-dimethyl-butyl] dihydrogen phosphate

Systemtic Name: [4-[1-ethyl-5-(5-phenylpentanoyl)pyrrol-2-yl]-2,2-dimethyl-butyl] dihydrogen phosphate Openeye Name: [4-[1-ethyl-5-(5-phenylpentanoyl)pyrrol-2-yl]-2,2-dimethyl-butyl] dihydrogen phosphate CAS Name: [4-[1-ethyl-5-(1-oxo-5-phenylpentyl)-2-pyrrolyl]-2,2-dimethylbutyl] dihydrogen phosphate IUPAC Name: [4-[1-ethyl-5-(5-phenylpentanoyl)pyrrol-2-yl]-2,2-dimethylbutyl] dihydrogen phosphate Traditional Name: [4-[1-ethyl-5-(5-phenylpentanoyl)pyrrol-2-yl]-2,2-dimethyl-butyl] dihydrogen phosphate Formula: C23H34NO5P MolecularWeight: 435.493521

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=C1C(=O)CCCCC2=CC=CC=C2)CCC(C)(C)COP(=O)(O)O

Isomeric SMILES

CCN1C(=CC=C1C(=O)CCCCC2=CC=CC=C2)CCC(C)(C)COP(=O)(O)O

InChI

InChI=1S/C23H34NO5P/c1-4-24-20(16-17-23(2,3)18-29-30(26,27)28)14-15-21(24)22(25)13-9-8-12-19-10-6-5-7-11-19/h5-7,10-11,14-15H,4,8-9,12-13,16-18H2,1-3H3,(H2,26,27,28)