(3R)-3-(4-chlorophenyl)-3-[2-(2-methoxy-4-prop-2-enyl-phenoxy)ethanoylamino]propanoate

Systemtic Name: (3R)-3-(4-chlorophenyl)-3-[2-(2-methoxy-4-prop-2-enyl-phenoxy)ethanoylamino]propanoate Openeye Name: (3R)-3-[[2-(4-allyl-2-methoxy-phenoxy)acetyl]amino]-3-(4-chlorophenyl)propanoate CAS Name: (3R)-3-(4-chlorophenyl)-3-[[2-(2-methoxy-4-prop-2-enylphenoxy)-1-oxoethyl]amino]propanoate IUPAC Name: (3R)-3-(4-chlorophenyl)-3-[[2-(2-methoxy-4-prop-2-enylphenoxy)acetyl]amino]propanoate Traditional Name: (3R)-3-[[2-(4-allyl-2-methoxy-phenoxy)acetyl]amino]-3-(4-chlorophenyl)propionate Formula: C21H21ClNO5- MolecularWeight: 402.84814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OCC(=O)NC(CC(=O)[O-])C2=CC=C(C=C2)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OCC(=O)N[C@H](CC(=O)[O-])C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H22ClNO5/c1-3-4-14-5-10-18(19(11-14)27-2)28-13-20(24)23-17(12-21(25)26)15-6-8-16(22)9-7-15/h3,5-11,17H,1,4,12-13H2,2H3,(H,23,24)(H,25,26)/p-1/t17-/m1/s1