methyl 10-oxidanyl-5,6,7,8-tetrahydrophenanthrene-9-carboxylate

Systemtic Name: methyl 10-oxidanyl-5,6,7,8-tetrahydrophenanthrene-9-carboxylate Openeye Name: methyl 10-hydroxy-5,6,7,8-tetrahydrophenanthrene-9-carboxylate CAS Name: 10-hydroxy-5,6,7,8-tetrahydrophenanthrene-9-carboxylic acid methyl ester IUPAC Name: methyl 10-hydroxy-5,6,7,8-tetrahydrophenanthrene-9-carboxylate Traditional Name: 10-hydroxy-5,6,7,8-tetrahydrophenanthrene-9-carboxylic acid methyl ester Formula: C16H16O3 MolecularWeight: 256.29644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2C3=C1CCCC3)O

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2C3=C1CCCC3)O

InChI

InChI=1S/C16H16O3/c1-19-16(18)14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)15(14)17/h3,5,7,9,17H,2,4,6,8H2,1H3