(2S)-3-(4-butoxy-3-methoxy-phenyl)-2-phenyl-propanoate

Systemtic Name: (2S)-3-(4-butoxy-3-methoxy-phenyl)-2-phenyl-propanoate Openeye Name: (2S)-3-(4-butoxy-3-methoxy-phenyl)-2-phenyl-propanoate CAS Name: (2S)-3-(4-butoxy-3-methoxyphenyl)-2-phenylpropanoate IUPAC Name: (2S)-3-(4-butoxy-3-methoxyphenyl)-2-phenylpropanoate Traditional Name: (2S)-3-(4-butoxy-3-methoxy-phenyl)-2-phenyl-propionate Formula: C20H23O4- MolecularWeight: 327.39422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CC(C2=CC=CC=C2)C(=O)[O-])OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C[C@@H](C2=CC=CC=C2)C(=O)[O-])OC

InChI

InChI=1S/C20H24O4/c1-3-4-12-24-18-11-10-15(14-19(18)23-2)13-17(20(21)22)16-8-6-5-7-9-16/h5-11,14,17H,3-4,12-13H2,1-2H3,(H,21,22)/p-1/t17-/m0/s1