(3R)-3-[[(2R)-2-phenylbutanoyl]amino]-3-(4-propan-2-yloxyphenyl)propanoic acid

Systemtic Name: (3R)-3-[[(2R)-2-phenylbutanoyl]amino]-3-(4-propan-2-yloxyphenyl)propanoic acid Openeye Name: (3R)-3-(4-isopropoxyphenyl)-3-[[(2R)-2-phenylbutanoyl]amino]propanoic acid CAS Name: (3R)-3-[[(2R)-1-oxo-2-phenylbutyl]amino]-3-(4-propan-2-yloxyphenyl)propanoic acid IUPAC Name: (3R)-3-[[(2R)-2-phenylbutanoyl]amino]-3-(4-propan-2-yloxyphenyl)propanoic acid Traditional Name: (3R)-3-(4-isopropoxyphenyl)-3-[[(2R)-2-phenylbutanoyl]amino]propionic acid Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC(CC(=O)O)C2=CC=C(C=C2)OC(C)C

Isomeric SMILES

CC[C@H](C1=CC=CC=C1)C(=O)N[C@H](CC(=O)O)C2=CC=C(C=C2)OC(C)C

InChI

InChI=1S/C22H27NO4/c1-4-19(16-8-6-5-7-9-16)22(26)23-20(14-21(24)25)17-10-12-18(13-11-17)27-15(2)3/h5-13,15,19-20H,4,14H2,1-3H3,(H,23,26)(H,24,25)/t19-,20-/m1/s1