methyl (1R,2R)-1-ethyl-7-oxidanyl-1,2,3,4-tetrahydrophenanthrene-2-carboxylate

Systemtic Name: methyl (1R,2R)-1-ethyl-7-oxidanyl-1,2,3,4-tetrahydrophenanthrene-2-carboxylate Openeye Name: methyl (1R,2R)-1-ethyl-7-hydroxy-1,2,3,4-tetrahydrophenanthrene-2-carboxylate CAS Name: (1R,2R)-1-ethyl-7-hydroxy-1,2,3,4-tetrahydrophenanthrene-2-carboxylic acid methyl ester IUPAC Name: methyl (1R,2R)-1-ethyl-7-hydroxy-1,2,3,4-tetrahydrophenanthrene-2-carboxylate Traditional Name: (1R,2R)-1-ethyl-7-hydroxy-1,2,3,4-tetrahydrophenanthrene-2-carboxylic acid methyl ester Formula: C18H20O3 MolecularWeight: 284.3496

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(CCC2=C1C=CC3=C2C=CC(=C3)O)C(=O)OC

Isomeric SMILES

CC[C@@H]1[C@@H](CCC2=C1C=CC3=C2C=CC(=C3)O)C(=O)OC

InChI

InChI=1S/C18H20O3/c1-3-13-15-6-4-11-10-12(19)5-7-14(11)16(15)8-9-17(13)18(20)21-2/h4-7,10,13,17,19H,3,8-9H2,1-2H3/t13-,17+/m0/s1