2-[2-[(3-azanyl-2-oxidanyl-heptanoyl)amino]ethanoylamino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[2-[(3-azanyl-2-oxidanyl-heptanoyl)amino]ethanoylamino]-2-phenyl-ethanoic acid Openeye Name: 2-[[2-[(3-amino-2-hydroxy-heptanoyl)amino]acetyl]amino]-2-phenyl-acetic acid CAS Name: 2-[[2-[(3-amino-2-hydroxy-1-oxoheptyl)amino]-1-oxoethyl]amino]-2-phenylacetic acid IUPAC Name: 2-[[2-[(3-amino-2-hydroxyheptanoyl)amino]acetyl]amino]-2-phenylacetic acid Traditional Name: 2-[[2-[(3-amino-2-hydroxy-heptanoyl)amino]acetyl]amino]-2-phenyl-acetic acid Formula: C17H25N3O5 MolecularWeight: 351.3975

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C(=O)NCC(=O)NC(C1=CC=CC=C1)C(=O)O)O)N

Isomeric SMILES

CCCCC(C(C(=O)NCC(=O)NC(C1=CC=CC=C1)C(=O)O)O)N

InChI

InChI=1S/C17H25N3O5/c1-2-3-9-12(18)15(22)16(23)19-10-13(21)20-14(17(24)25)11-7-5-4-6-8-11/h4-8,12,14-15,22H,2-3,9-10,18H2,1H3,(H,19,23)(H,20,21)(H,24,25)