(1R,4aS)-10,10-dideuterio-1,4a-dimethyl-7-propan-2-yl-3,4,9,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid

Systemtic Name: (1R,4aS)-10,10-dideuterio-1,4a-dimethyl-7-propan-2-yl-3,4,9,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid Openeye Name: (1R,4aS)-10,10-dideuterio-7-isopropyl-1,4a-dimethyl-3,4,9,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid CAS Name: (1R,4aS)-10,10-dideuterio-1,4a-dimethyl-7-propan-2-yl-3,4,9,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid IUPAC Name: (1R,4aS)-10,10-dideuterio-1,4a-dimethyl-7-propan-2-yl-3,4,9,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid Traditional Name: (1R,4aS)-10,10-dideuterio-7-isopropyl-1,4a-dimethyl-3,4,9,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid Formula: C20H28O2 MolecularWeight: 302.447444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)C(=O)O)C

Isomeric SMILES

[2H]C1(CC2=C(C=CC(=C2)C(C)C)[C@@]3(C1[C@](CCC3)(C)C(=O)O)C)[2H]

InChI

InChI=1S/C20H28O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h6,8,12-13,17H,5,7,9-11H2,1-4H3,(H,21,22)/t17?,19-,20-/m1/s1/i9D2