N-[2-[[(2R)-2-acetamido-3-phenyl-propanoyl]amino]ethyl]-2-azanyl-3-(4-hydroxyphenyl)propanamide

Systemtic Name: N-[2-[[(2R)-2-acetamido-3-phenyl-propanoyl]amino]ethyl]-2-azanyl-3-(4-hydroxyphenyl)propanamide Openeye Name: N-[2-[[(2R)-2-acetamido-3-phenyl-propanoyl]amino]ethyl]-2-amino-3-(4-hydroxyphenyl)propanamide CAS Name: N-[2-[[(2R)-2-acetamido-1-oxo-3-phenylpropyl]amino]ethyl]-2-amino-3-(4-hydroxyphenyl)propanamide IUPAC Name: N-[2-[[(2R)-2-acetamido-3-phenylpropanoyl]amino]ethyl]-2-amino-3-(4-hydroxyphenyl)propanamide Traditional Name: N-[2-[[(2R)-2-acetamido-3-phenyl-propanoyl]amino]ethyl]-2-amino-3-(4-hydroxyphenyl)propionamide Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)N[C@H](CC1=CC=CC=C1)C(=O)NCCNC(=O)C(CC2=CC=C(C=C2)O)N

InChI

InChI=1S/C22H28N4O4/c1-15(27)26-20(14-16-5-3-2-4-6-16)22(30)25-12-11-24-21(29)19(23)13-17-7-9-18(28)10-8-17/h2-10,19-20,28H,11-14,23H2,1H3,(H,24,29)(H,25,30)(H,26,27)/t19?,20-/m1/s1