3-benzamido-2-[[4-[(3-hydroxyphenyl)methylcarbamoyl]-2-methyl-phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-benzamido-2-[[4-[(3-hydroxyphenyl)methylcarbamoyl]-2-methyl-phenyl]carbonylamino]propanoic acid Openeye Name: 3-benzamido-2-[[4-[(3-hydroxyphenyl)methylcarbamoyl]-2-methyl-benzoyl]amino]propanoic acid CAS Name: 3-benzamido-2-[[[4-[[(3-hydroxyphenyl)methylamino]-oxomethyl]-2-methylphenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-benzamido-2-[[4-[(3-hydroxyphenyl)methylcarbamoyl]-2-methylbenzoyl]amino]propanoic acid Traditional Name: 3-benzamido-2-[[4-[(3-hydroxybenzyl)carbamoyl]-2-methyl-benzoyl]amino]propionic acid Formula: C26H25N3O6 MolecularWeight: 475.4932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC2=CC(=CC=C2)O)C(=O)NC(CNC(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC2=CC(=CC=C2)O)C(=O)NC(CNC(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C26H25N3O6/c1-16-12-19(24(32)27-14-17-6-5-9-20(30)13-17)10-11-21(16)25(33)29-22(26(34)35)15-28-23(31)18-7-3-2-4-8-18/h2-13,22,30H,14-15H2,1H3,(H,27,32)(H,28,31)(H,29,33)(H,34,35)