calcium; (Z)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoic acid

Systemtic Name: calcium; (Z)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoic acid Openeye Name: calcium; (Z)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoic acid CAS Name: calcium; (Z)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoic acid IUPAC Name: calcium; (Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid Traditional Name: calcium; (Z)-3-(4-hydroxy-3-methoxy-phenyl)acrylic acid Formula: C10H10CaO4 MolecularWeight: 234.262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)O)O.[Ca]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C\C(=O)O)O.[Ca]

InChI

InChI=1S/C10H10O4.Ca/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13;/h2-6,11H,1H3,(H,12,13);/b5-3-;