2-[2-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]ethanoylamino]-3-methyl-pentanoic acid

Systemtic Name: 2-[2-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]ethanoylamino]-3-methyl-pentanoic acid Openeye Name: 2-[[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]-3-methyl-pentanoic acid CAS Name: 2-[[2-[[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxoethyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]-3-methylpentanoic acid Traditional Name: 3-methyl-2-[[2-(tyrosylamino)acetyl]amino]valeric acid Formula: C17H25N3O5 MolecularWeight: 351.3975

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)CNC(=O)C(CC1=CC=C(C=C1)O)N

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)CNC(=O)C(CC1=CC=C(C=C1)O)N

InChI

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