methyl 5-methoxy-8-phenyl-2,3,7,8,9,9a-hexahydro-1H-phenalene-1-carboxylate

Systemtic Name: methyl 5-methoxy-8-phenyl-2,3,7,8,9,9a-hexahydro-1H-phenalene-1-carboxylate Openeye Name: methyl 5-methoxy-8-phenyl-2,3,7,8,9,9a-hexahydro-1H-phenalene-1-carboxylate CAS Name: 5-methoxy-8-phenyl-2,3,7,8,9,9a-hexahydro-1H-phenalene-1-carboxylic acid methyl ester IUPAC Name: methyl 5-methoxy-8-phenyl-2,3,7,8,9,9a-hexahydro-1H-phenalene-1-carboxylate Traditional Name: 5-methoxy-8-phenyl-2,3,7,8,9,9a-hexahydro-1H-phenalene-1-carboxylic acid methyl ester Formula: C22H24O3 MolecularWeight: 336.42416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C3C(CC(C2)C4=CC=CC=C4)C(CCC3=C1)C(=O)OC

Isomeric SMILES

COC1=CC2=C3C(CC(C2)C4=CC=CC=C4)C(CCC3=C1)C(=O)OC

InChI

InChI=1S/C22H24O3/c1-24-18-11-15-8-9-19(22(23)25-2)20-13-16(10-17(12-18)21(15)20)14-6-4-3-5-7-14/h3-7,11-12,16,19-20H,8-10,13H2,1-2H3