(E)-3-[3-(4-chlorophenyl)-1-adamantyl]-1-(9-ethylcarbazol-3-yl)prop-2-en-1-one

Systemtic Name: (E)-3-[3-(4-chlorophenyl)-1-adamantyl]-1-(9-ethylcarbazol-3-yl)prop-2-en-1-one Openeye Name: (E)-3-[3-(4-chlorophenyl)-1-adamantyl]-1-(9-ethylcarbazol-3-yl)prop-2-en-1-one CAS Name: (E)-3-[3-(4-chlorophenyl)-1-adamantyl]-1-(9-ethyl-3-carbazolyl)-2-propen-1-one IUPAC Name: (E)-3-[3-(4-chlorophenyl)-1-adamantyl]-1-(9-ethylcarbazol-3-yl)prop-2-en-1-one Traditional Name: (E)-3-[3-(4-chlorophenyl)-1-adamantyl]-1-(9-ethylcarbazol-3-yl)prop-2-en-1-one Formula: C33H32ClNO MolecularWeight: 494.06628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)C=CC34CC5CC(C3)CC(C5)(C4)C6=CC=C(C=C6)Cl)C7=CC=CC=C71

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)/C=C/C34CC5CC(C3)CC(C5)(C4)C6=CC=C(C=C6)Cl)C7=CC=CC=C71

InChI

InChI=1S/C33H32ClNO/c1-2-35-29-6-4-3-5-27(29)28-16-24(7-12-30(28)35)31(36)13-14-32-17-22-15-23(18-32)20-33(19-22,21-32)25-8-10-26(34)11-9-25/h3-14,16,22-23H,2,15,17-21H2,1H3/b14-13+