2-[[2-[[2-azanyl-3-(3-hydroxyphenyl)propanoyl]amino]-3-methyl-butanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[2-[[2-azanyl-3-(3-hydroxyphenyl)propanoyl]amino]-3-methyl-butanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-[[2-amino-3-(3-hydroxyphenyl)propanoyl]amino]-3-methyl-butanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-[[2-amino-3-(3-hydroxyphenyl)-1-oxopropyl]amino]-3-methyl-1-oxobutyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-[[2-amino-3-(3-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-[[2-amino-3-(3-hydroxyphenyl)propanoyl]amino]-3-methyl-butanoyl]amino]-3-phenyl-propionic acid Formula: C23H29N3O5 MolecularWeight: 427.49346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)C(CC2=CC(=CC=C2)O)N

Isomeric SMILES

CC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)C(CC2=CC(=CC=C2)O)N

InChI

InChI=1S/C23H29N3O5/c1-14(2)20(26-21(28)18(24)12-16-9-6-10-17(27)11-16)22(29)25-19(23(30)31)13-15-7-4-3-5-8-15/h3-11,14,18-20,27H,12-13,24H2,1-2H3,(H,25,29)(H,26,28)(H,30,31)