2-[2-[(2-azanyl-4-methyl-pentanoyl)amino]propanoylamino]-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: 2-[2-[(2-azanyl-4-methyl-pentanoyl)amino]propanoylamino]-3-(4-hydroxyphenyl)propanoic acid Openeye Name: 2-[2-[(2-amino-4-methyl-pentanoyl)amino]propanoylamino]-3-(4-hydroxyphenyl)propanoic acid CAS Name: 2-[[2-[(2-amino-4-methyl-1-oxopentyl)amino]-1-oxopropyl]amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: 2-[2-[(2-amino-4-methylpentanoyl)amino]propanoylamino]-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 2-[2-[(2-amino-4-methyl-pentanoyl)amino]propanoylamino]-3-(4-hydroxyphenyl)propionic acid Formula: C18H27N3O5 MolecularWeight: 365.42408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O5/c1-10(2)8-14(19)17(24)20-11(3)16(23)21-15(18(25)26)9-12-4-6-13(22)7-5-12/h4-7,10-11,14-15,22H,8-9,19H2,1-3H3,(H,20,24)(H,21,23)(H,25,26)