9-(3-bromanyl-4-prop-2-ynoxy-phenyl)-3,3,6,6,10-pentamethyl-4,5,7,9-tetrahydro-2H-acridine-1,8-dione

Systemtic Name: 9-(3-bromanyl-4-prop-2-ynoxy-phenyl)-3,3,6,6,10-pentamethyl-4,5,7,9-tetrahydro-2H-acridine-1,8-dione Openeye Name: 9-(3-bromo-4-prop-2-ynoxy-phenyl)-3,3,6,6,10-pentamethyl-4,5,7,9-tetrahydro-2H-acridine-1,8-dione CAS Name: 9-(3-bromo-4-prop-2-ynoxyphenyl)-3,3,6,6,10-pentamethyl-4,5,7,9-tetrahydro-2H-acridine-1,8-dione IUPAC Name: 9-(3-bromo-4-prop-2-ynoxyphenyl)-3,3,6,6,10-pentamethyl-4,5,7,9-tetrahydro-2H-acridine-1,8-dione Traditional Name: 9-(3-bromo-4-propargyloxy-phenyl)-3,3,6,6,10-pentamethyl-4,5,7,9-tetrahydro-2H-acridine-1,8-quinone Formula: C27H30BrNO3 MolecularWeight: 496.436

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C3=C(N2C)CC(CC3=O)(C)C)C4=CC(=C(C=C4)OCC#C)Br)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C3=C(N2C)CC(CC3=O)(C)C)C4=CC(=C(C=C4)OCC#C)Br)C(=O)C1)C

InChI

InChI=1S/C27H30BrNO3/c1-7-10-32-22-9-8-16(11-17(22)28)23-24-18(12-26(2,3)14-20(24)30)29(6)19-13-27(4,5)15-21(31)25(19)23/h1,8-9,11,23H,10,12-15H2,2-6H3