1,1-dimethyl-3-oxidanylidene-4,9,10,10a-tetrahydro-2H-phenanthrene-4a-carboxylic acid

Systemtic Name: 1,1-dimethyl-3-oxidanylidene-4,9,10,10a-tetrahydro-2H-phenanthrene-4a-carboxylic acid Openeye Name: 1,1-dimethyl-3-oxo-4,9,10,10a-tetrahydro-2H-phenanthrene-4a-carboxylic acid CAS Name: 1,1-dimethyl-3-oxo-4,9,10,10a-tetrahydro-2H-phenanthrene-4a-carboxylic acid IUPAC Name: 1,1-dimethyl-3-oxo-4,9,10,10a-tetrahydro-2H-phenanthrene-4a-carboxylic acid Traditional Name: 3-keto-1,1-dimethyl-4,9,10,10a-tetrahydro-2H-phenanthrene-4a-carboxylic acid Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)CC2(C1CCC3=CC=CC=C32)C(=O)O)C

Isomeric SMILES

CC1(CC(=O)CC2(C1CCC3=CC=CC=C32)C(=O)O)C

InChI

InChI=1S/C17H20O3/c1-16(2)9-12(18)10-17(15(19)20)13-6-4-3-5-11(13)7-8-14(16)17/h3-6,14H,7-10H2,1-2H3,(H,19,20)