3-methoxy-5-oxidanylidene-2-phenylmethoxy-6,7,8,9-tetrahydrobenzo[7]annulene-6-carboxylic acid

Systemtic Name: 3-methoxy-5-oxidanylidene-2-phenylmethoxy-6,7,8,9-tetrahydrobenzo[7]annulene-6-carboxylic acid Openeye Name: 2-benzyloxy-3-methoxy-5-oxo-6,7,8,9-tetrahydrobenzo[7]annulene-6-carboxylic acid CAS Name: 3-methoxy-5-oxo-2-phenylmethoxy-6,7,8,9-tetrahydrobenzo[7]annulene-6-carboxylic acid IUPAC Name: 3-methoxy-5-oxo-2-phenylmethoxy-6,7,8,9-tetrahydrobenzo[7]annulene-6-carboxylic acid Traditional Name: 2-benzoxy-5-keto-3-methoxy-6,7,8,9-tetrahydrobenzocycloheptene-6-carboxylic acid Formula: C20H20O5 MolecularWeight: 340.3698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CCCC(C(=O)C2=C1)C(=O)O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C2CCCC(C(=O)C2=C1)C(=O)O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H20O5/c1-24-17-11-16-14(8-5-9-15(19(16)21)20(22)23)10-18(17)25-12-13-6-3-2-4-7-13/h2-4,6-7,10-11,15H,5,8-9,12H2,1H3,(H,22,23)