9-(hexadecylamino)-3,4-dihydro-2H-acridin-10-ium-1-one

Systemtic Name: 9-(hexadecylamino)-3,4-dihydro-2H-acridin-10-ium-1-one Openeye Name: 9-(hexadecylamino)-3,4-dihydro-2H-acridin-10-ium-1-one CAS Name: 9-(hexadecylamino)-3,4-dihydro-2H-acridin-10-ium-1-one IUPAC Name: 9-(hexadecylamino)-3,4-dihydro-2H-acridin-10-ium-1-one Traditional Name: 9-(cetylamino)-3,4-dihydro-2H-acridin-10-ium-1-one Formula: C29H45N2O+ MolecularWeight: 437.6804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=C2C(=[NH+]C3=CC=CC=C31)CCCC2=O

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=C2C(=[NH+]C3=CC=CC=C31)CCCC2=O

InChI

InChI=1S/C29H44N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-23-30-29-24-19-15-16-20-25(24)31-26-21-18-22-27(32)28(26)29/h15-16,19-20H,2-14,17-18,21-23H2,1H3,(H,30,31)/p+1