2-[2-[2-(2-azanylpropanoylamino)propanoylamino]ethanoylamino]-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: 2-[2-[2-(2-azanylpropanoylamino)propanoylamino]ethanoylamino]-3-(4-hydroxyphenyl)propanoic acid Openeye Name: 2-[[2-[2-(2-aminopropanoylamino)propanoylamino]acetyl]amino]-3-(4-hydroxyphenyl)propanoic acid CAS Name: 2-[[2-[[2-[(2-amino-1-oxopropyl)amino]-1-oxopropyl]amino]-1-oxoethyl]amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: 2-[[2-[2-(2-aminopropanoylamino)propanoylamino]acetyl]amino]-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 2-[[2-[2-(alanylamino)propanoylamino]acetyl]amino]-3-(4-hydroxyphenyl)propionic acid Formula: C17H24N4O6 MolecularWeight: 380.39566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N4O6/c1-9(18)15(24)20-10(2)16(25)19-8-14(23)21-13(17(26)27)7-11-3-5-12(22)6-4-11/h3-6,9-10,13,22H,7-8,18H2,1-2H3,(H,19,25)(H,20,24)(H,21,23)(H,26,27)