3-[5-oxidanylidene-6-(phenylmethyl)-8,9-dihydro-7H-benzo[7]annulen-6-yl]propanoic acid

Systemtic Name: 3-[5-oxidanylidene-6-(phenylmethyl)-8,9-dihydro-7H-benzo[7]annulen-6-yl]propanoic acid Openeye Name: 3-(6-benzyl-5-oxo-8,9-dihydro-7H-benzo[7]annulen-6-yl)propanoic acid CAS Name: 3-[5-oxo-6-(phenylmethyl)-8,9-dihydro-7H-benzo[7]annulen-6-yl]propanoic acid IUPAC Name: 3-(6-benzyl-5-oxo-8,9-dihydro-7H-benzo[7]annulen-6-yl)propanoic acid Traditional Name: 3-(6-benzyl-5-keto-8,9-dihydro-7H-benzocyclohepten-6-yl)propionic acid Formula: C21H22O3 MolecularWeight: 322.39758

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2C(=O)C(C1)(CCC(=O)O)CC3=CC=CC=C3

Isomeric SMILES

C1CC2=CC=CC=C2C(=O)C(C1)(CCC(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C21H22O3/c22-19(23)12-14-21(15-16-7-2-1-3-8-16)13-6-10-17-9-4-5-11-18(17)20(21)24/h1-5,7-9,11H,6,10,12-15H2,(H,22,23)