(4aS,10aR)-2,3,4,9,10,10a-hexahydro-1H-phenanthrene-4a-carboxylic acid

Systemtic Name: (4aS,10aR)-2,3,4,9,10,10a-hexahydro-1H-phenanthrene-4a-carboxylic acid Openeye Name: (4aS,10aR)-2,3,4,9,10,10a-hexahydro-1H-phenanthrene-4a-carboxylic acid CAS Name: (4aS,10aR)-2,3,4,9,10,10a-hexahydro-1H-phenanthrene-4a-carboxylic acid IUPAC Name: (4aS,10aR)-2,3,4,9,10,10a-hexahydro-1H-phenanthrene-4a-carboxylic acid Traditional Name: (4aS,10aR)-2,3,4,9,10,10a-hexahydro-1H-phenanthrene-4a-carboxylic acid Formula: C15H18O2 MolecularWeight: 230.30222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C(C1)CCC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1CC[C@@]2([C@H](C1)CCC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C15H18O2/c16-14(17)15-10-4-3-6-12(15)9-8-11-5-1-2-7-13(11)15/h1-2,5,7,12H,3-4,6,8-10H2,(H,16,17)/t12-,15+/m1/s1