(E)-3-[6-(acridin-9-ylamino)hexylamino]-2-diazonio-1-ethoxy-3-oxidanylidene-prop-1-en-1-olate

Systemtic Name: (E)-3-[6-(acridin-9-ylamino)hexylamino]-2-diazonio-1-ethoxy-3-oxidanylidene-prop-1-en-1-olate Openeye Name: (E)-3-[6-(acridin-9-ylamino)hexylamino]-2-diazonio-1-ethoxy-3-oxo-prop-1-en-1-olate CAS Name: (E)-3-[6-(9-acridinylamino)hexylamino]-2-diazonio-1-ethoxy-3-oxo-1-propen-1-olate IUPAC Name: (E)-3-[6-(acridin-9-ylamino)hexylamino]-2-diazonio-1-ethoxy-3-oxoprop-1-en-1-olate Traditional Name: (E)-3-[6-(acridin-9-ylamino)hexylamino]-2-diazonio-1-ethoxy-3-keto-prop-1-en-1-olate Formula: C24H27N5O3 MolecularWeight: 433.50288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)NCCCCCCNC1=C2C=CC=CC2=NC3=CC=CC=C31)[N+]#N)[O-]

Isomeric SMILES

CCO/C(=C(\C(=O)NCCCCCCNC1=C2C=CC=CC2=NC3=CC=CC=C31)/[N+]#N)/[O-]

InChI

InChI=1S/C24H27N5O3/c1-2-32-24(31)22(29-25)23(30)27-16-10-4-3-9-15-26-21-17-11-5-7-13-19(17)28-20-14-8-6-12-18(20)21/h5-8,11-14H,2-4,9-10,15-16H2,1H3,(H2-,26,27,28,30,31)