(3S)-3-(2,5-dimethylphenyl)-3-(3-methylphenyl)propanoate

Systemtic Name: (3S)-3-(2,5-dimethylphenyl)-3-(3-methylphenyl)propanoate Openeye Name: (3S)-3-(2,5-dimethylphenyl)-3-(m-tolyl)propanoate CAS Name: (3S)-3-(2,5-dimethylphenyl)-3-(3-methylphenyl)propanoate IUPAC Name: (3S)-3-(2,5-dimethylphenyl)-3-(3-methylphenyl)propanoate Traditional Name: (3S)-3-(2,5-dimethylphenyl)-3-(m-tolyl)propionate Formula: C18H19O2- MolecularWeight: 267.34226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(CC(=O)[O-])C2=C(C=CC(=C2)C)C

Isomeric SMILES

CC1=CC(=CC=C1)[C@H](CC(=O)[O-])C2=C(C=CC(=C2)C)C

InChI

InChI=1S/C18H20O2/c1-12-5-4-6-15(9-12)17(11-18(19)20)16-10-13(2)7-8-14(16)3/h4-10,17H,11H2,1-3H3,(H,19,20)/p-1/t17-/m0/s1