4-[7-[4-(acridin-9-ylamino)phenyl]heptoxy]naphthalene-1,2-dione

Systemtic Name: 4-[7-[4-(acridin-9-ylamino)phenyl]heptoxy]naphthalene-1,2-dione Openeye Name: 4-[7-[4-(acridin-9-ylamino)phenyl]heptoxy]naphthalene-1,2-dione CAS Name: 4-[7-[4-(9-acridinylamino)phenyl]heptoxy]naphthalene-1,2-dione IUPAC Name: 4-[7-[4-(acridin-9-ylamino)phenyl]heptoxy]naphthalene-1,2-dione Traditional Name: 4-[7-[4-(acridin-9-ylamino)phenyl]heptoxy]-1,2-naphthoquinone Formula: C36H32N2O3 MolecularWeight: 540.65088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=O)C2=O)OCCCCCCCC3=CC=C(C=C3)NC4=C5C=CC=CC5=NC6=CC=CC=C64

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=O)C2=O)OCCCCCCCC3=CC=C(C=C3)NC4=C5C=CC=CC5=NC6=CC=CC=C64

InChI

InChI=1S/C36H32N2O3/c39-33-24-34(27-13-5-6-14-28(27)36(33)40)41-23-11-3-1-2-4-12-25-19-21-26(22-20-25)37-35-29-15-7-9-17-31(29)38-32-18-10-8-16-30(32)35/h5-10,13-22,24H,1-4,11-12,23H2,(H,37,38)