potassium (3S)-3-cyano-3-(4-methoxyphenyl)propanoate

Systemtic Name: potassium (3S)-3-cyano-3-(4-methoxyphenyl)propanoate Openeye Name: potassium (3S)-3-cyano-3-(4-methoxyphenyl)propanoate CAS Name: potassium (3S)-3-cyano-3-(4-methoxyphenyl)propanoate IUPAC Name: potassium (3S)-3-cyano-3-(4-methoxyphenyl)propanoate Traditional Name: potassium (3S)-3-cyano-3-(4-methoxyphenyl)propionate Formula: C11H10KNO3 MolecularWeight: 243.3003

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC(=O)[O-])C#N.[K+]

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CC(=O)[O-])C#N.[K+]

InChI

InChI=1S/C11H11NO3.K/c1-15-10-4-2-8(3-5-10)9(7-12)6-11(13)14;/h2-5,9H,6H2,1H3,(H,13,14);/q;+1/p-1/t9-;/m1./s1