[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] 3-chloranyl-4-ethoxy-5-methoxy-benzoate

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] 3-chloranyl-4-ethoxy-5-methoxy-benzoate Openeye Name: (2-indan-5-yl-2-oxo-ethyl) 3-chloro-4-ethoxy-5-methoxy-benzoate CAS Name: 3-chloro-4-ethoxy-5-methoxybenzoic acid [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] 3-chloro-4-ethoxy-5-methoxybenzoate Traditional Name: 3-chloro-4-ethoxy-5-methoxy-benzoic acid (2-indan-5-yl-2-keto-ethyl) ester Formula: C21H21ClO5 MolecularWeight: 388.84144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)C2=CC3=C(CCC3)C=C2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)C2=CC3=C(CCC3)C=C2)OC

InChI

InChI=1S/C21H21ClO5/c1-3-26-20-17(22)10-16(11-19(20)25-2)21(24)27-12-18(23)15-8-7-13-5-4-6-14(13)9-15/h7-11H,3-6,12H2,1-2H3