1-(carboxymethyl)-7-methoxy-2-methyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthrene-2-carboxylic acid

Systemtic Name: 1-(carboxymethyl)-7-methoxy-2-methyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthrene-2-carboxylic acid Openeye Name: 1-(carboxymethyl)-7-methoxy-2-methyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthrene-2-carboxylic acid CAS Name: 1-(carboxymethyl)-7-methoxy-2-methyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthrene-2-carboxylic acid IUPAC Name: 1-(carboxymethyl)-7-methoxy-2-methyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthrene-2-carboxylic acid Traditional Name: 1-(carboxymethyl)-7-methoxy-2-methyl-3,4,4a,9,10,10a-hexahydro-1H-phenanthrene-2-carboxylic acid Formula: C19H24O5 MolecularWeight: 332.39086

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2C(C1CC(=O)O)CCC3=C2C=CC(=C3)OC)C(=O)O

Isomeric SMILES

CC1(CCC2C(C1CC(=O)O)CCC3=C2C=CC(=C3)OC)C(=O)O

InChI

InChI=1S/C19H24O5/c1-19(18(22)23)8-7-14-13-6-4-12(24-2)9-11(13)3-5-15(14)16(19)10-17(20)21/h4,6,9,14-16H,3,5,7-8,10H2,1-2H3,(H,20,21)(H,22,23)