7-bromanyl-3,3-dimethyl-9-(pentadecylamino)-2,4-dihydroacridin-10-ium-1-one

Systemtic Name: 7-bromanyl-3,3-dimethyl-9-(pentadecylamino)-2,4-dihydroacridin-10-ium-1-one Openeye Name: 7-bromo-3,3-dimethyl-9-(pentadecylamino)-2,4-dihydroacridin-10-ium-1-one CAS Name: 7-bromo-3,3-dimethyl-9-(pentadecylamino)-2,4-dihydroacridin-10-ium-1-one IUPAC Name: 7-bromo-3,3-dimethyl-9-(pentadecylamino)-2,4-dihydroacridin-10-ium-1-one Traditional Name: 7-bromo-3,3-dimethyl-9-(pentadecylamino)-2,4-dihydroacridin-10-ium-1-one Formula: C30H46BrN2O+ MolecularWeight: 530.60304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCNC1=C2C(=[NH+]C3=C1C=C(C=C3)Br)CC(CC2=O)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCNC1=C2C(=[NH+]C3=C1C=C(C=C3)Br)CC(CC2=O)(C)C

InChI

InChI=1S/C30H45BrN2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-32-29-24-20-23(31)17-18-25(24)33-26-21-30(2,3)22-27(34)28(26)29/h17-18,20H,4-16,19,21-22H2,1-3H3,(H,32,33)/p+1