6-azanyl-2-[[cyclopropyl-(3-phenylpropanoylamino)methyl]-oxidanyl-phosphoryl]oxy-hexanoic acid

Systemtic Name: 6-azanyl-2-[[cyclopropyl-(3-phenylpropanoylamino)methyl]-oxidanyl-phosphoryl]oxy-hexanoic acid Openeye Name: 6-amino-2-[[cyclopropyl-(3-phenylpropanoylamino)methyl]-hydroxy-phosphoryl]oxy-hexanoic acid CAS Name: 6-amino-2-[[cyclopropyl-[(1-oxo-3-phenylpropyl)amino]methyl]-hydroxyphosphoryl]oxyhexanoic acid IUPAC Name: 6-amino-2-[[cyclopropyl-(3-phenylpropanoylamino)methyl]-hydroxyphosphoryl]oxyhexanoic acid Traditional Name: 6-amino-2-[[cyclopropyl-(hydrocinnamoylamino)methyl]-hydroxy-phosphoryl]oxy-hexanoic acid Formula: C19H29N2O6P MolecularWeight: 412.417121

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(NC(=O)CCC2=CC=CC=C2)P(=O)(O)OC(CCCCN)C(=O)O

Isomeric SMILES

C1CC1C(NC(=O)CCC2=CC=CC=C2)P(=O)(O)OC(CCCCN)C(=O)O

InChI

InChI=1S/C19H29N2O6P/c20-13-5-4-8-16(19(23)24)27-28(25,26)18(15-10-11-15)21-17(22)12-9-14-6-2-1-3-7-14/h1-3,6-7,15-16,18H,4-5,8-13,20H2,(H,21,22)(H,23,24)(H,25,26)