7-azanyl-2-[oxidanyl-[1-(3-phenylpropanoylamino)cyclopentyl]phosphoryl]oxy-heptanoic acid

Systemtic Name: 7-azanyl-2-[oxidanyl-[1-(3-phenylpropanoylamino)cyclopentyl]phosphoryl]oxy-heptanoic acid Openeye Name: 7-amino-2-[hydroxy-[1-(3-phenylpropanoylamino)cyclopentyl]phosphoryl]oxy-heptanoic acid CAS Name: 7-amino-2-[hydroxy-[1-[(1-oxo-3-phenylpropyl)amino]cyclopentyl]phosphoryl]oxyheptanoic acid IUPAC Name: 7-amino-2-[hydroxy-[1-(3-phenylpropanoylamino)cyclopentyl]phosphoryl]oxyheptanoic acid Traditional Name: 7-amino-2-[[1-(hydrocinnamoylamino)cyclopentyl]-hydroxy-phosphoryl]oxy-enanthic acid Formula: C21H33N2O6P MolecularWeight: 440.470281

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(NC(=O)CCC2=CC=CC=C2)P(=O)(O)OC(CCCCCN)C(=O)O

Isomeric SMILES

C1CCC(C1)(NC(=O)CCC2=CC=CC=C2)P(=O)(O)OC(CCCCCN)C(=O)O

InChI

InChI=1S/C21H33N2O6P/c22-16-8-2-5-11-18(20(25)26)29-30(27,28)21(14-6-7-15-21)23-19(24)13-12-17-9-3-1-4-10-17/h1,3-4,9-10,18H,2,5-8,11-16,22H2,(H,23,24)(H,25,26)(H,27,28)