2-[[6-azanyl-2-[oxidanyl(4-phenylbutyl)phosphoryl]oxy-hexanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[6-azanyl-2-[oxidanyl(4-phenylbutyl)phosphoryl]oxy-hexanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[6-amino-2-[hydroxy(4-phenylbutyl)phosphoryl]oxy-hexanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[6-amino-2-[hydroxy(4-phenylbutyl)phosphoryl]oxy-1-oxohexyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[6-amino-2-[hydroxy(4-phenylbutyl)phosphoryl]oxyhexanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[6-amino-2-[hydroxy(4-phenylbutyl)phosphoryl]oxy-hexanoyl]amino]-3-phenyl-propionic acid Formula: C25H35N2O6P MolecularWeight: 490.528961

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCP(=O)(O)OC(CCCCN)C(=O)NC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCP(=O)(O)OC(CCCCN)C(=O)NC(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C25H35N2O6P/c26-17-9-7-16-23(24(28)27-22(25(29)30)19-21-14-5-2-6-15-21)33-34(31,32)18-10-8-13-20-11-3-1-4-12-20/h1-6,11-12,14-15,22-23H,7-10,13,16-19,26H2,(H,27,28)(H,29,30)(H,31,32)