(Z)-6-(acridin-9-ylamino)hexoxy-(2-diazoniocyclopenta-2,4-dien-1-ylidene)methanolate

Systemtic Name: (Z)-6-(acridin-9-ylamino)hexoxy-(2-diazoniocyclopenta-2,4-dien-1-ylidene)methanolate Openeye Name: (Z)-6-(acridin-9-ylamino)hexoxy-(2-diazoniocyclopenta-2,4-dien-1-ylidene)methanolate CAS Name: (Z)-6-(9-acridinylamino)hexoxy-(2-diazonio-1-cyclopenta-2,4-dienylidene)methanolate IUPAC Name: (Z)-6-(acridin-9-ylamino)hexoxy-(2-diazoniocyclopenta-2,4-dien-1-ylidene)methanolate Traditional Name: (Z)-6-(acridin-9-ylamino)hexoxy-(2-diazoniocyclopenta-2,4-dien-1-ylidene)methanolate Formula: C25H24N4O2 MolecularWeight: 412.48366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCCCCOC(=C4C=CC=C4[N+]#N)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCCCCO/C(=C\4/C=CC=C4[N+]#N)/[O-]

InChI

InChI=1S/C25H24N4O2/c26-29-23-15-9-12-20(23)25(30)31-17-8-2-1-7-16-27-24-18-10-3-5-13-21(18)28-22-14-6-4-11-19(22)24/h3-6,9-15H,1-2,7-8,16-17H2,(H-,27,28,30)/b25-20-