4a-isocyanato-1,2,3,4,10,10a-hexahydrophenanthren-9-one

Systemtic Name: 4a-isocyanato-1,2,3,4,10,10a-hexahydrophenanthren-9-one Openeye Name: 4a-isocyanato-1,2,3,4,10,10a-hexahydrophenanthren-9-one CAS Name: 4a-isocyanato-1,2,3,4,10,10a-hexahydrophenanthren-9-one IUPAC Name: 4a-isocyanato-1,2,3,4,10,10a-hexahydrophenanthren-9-one Traditional Name: 4a-isocyanato-1,2,3,4,10,10a-hexahydrophenanthren-9-one Formula: C15H15NO2 MolecularWeight: 241.2851

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C(C1)CC(=O)C3=CC=CC=C32)N=C=O

Isomeric SMILES

C1CCC2(C(C1)CC(=O)C3=CC=CC=C32)N=C=O

InChI

InChI=1S/C15H15NO2/c17-10-16-15-8-4-3-5-11(15)9-14(18)12-6-1-2-7-13(12)15/h1-2,6-7,11H,3-5,8-9H2