7-azanyl-2-[[[2-methyl-1-(3-phenylpropanoylamino)propyl]-oxidanyl-phosphoryl]methyl]heptanoic acid

Systemtic Name: 7-azanyl-2-[[[2-methyl-1-(3-phenylpropanoylamino)propyl]-oxidanyl-phosphoryl]methyl]heptanoic acid Openeye Name: 7-amino-2-[[hydroxy-[2-methyl-1-(3-phenylpropanoylamino)propyl]phosphoryl]methyl]heptanoic acid CAS Name: 7-amino-2-[[hydroxy-[2-methyl-1-[(1-oxo-3-phenylpropyl)amino]propyl]phosphoryl]methyl]heptanoic acid IUPAC Name: 7-amino-2-[[hydroxy-[2-methyl-1-(3-phenylpropanoylamino)propyl]phosphoryl]methyl]heptanoic acid Traditional Name: 7-amino-2-[[[1-(hydrocinnamoylamino)-2-methyl-propyl]-hydroxy-phosphoryl]methyl]enanthic acid Formula: C21H35N2O5P MolecularWeight: 426.486761

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(NC(=O)CCC1=CC=CC=C1)P(=O)(CC(CCCCCN)C(=O)O)O

Isomeric SMILES

CC(C)C(NC(=O)CCC1=CC=CC=C1)P(=O)(CC(CCCCCN)C(=O)O)O

InChI

InChI=1S/C21H35N2O5P/c1-16(2)20(23-19(24)13-12-17-9-5-3-6-10-17)29(27,28)15-18(21(25)26)11-7-4-8-14-22/h3,5-6,9-10,16,18,20H,4,7-8,11-15,22H2,1-2H3,(H,23,24)(H,25,26)(H,27,28)