4-[8-[4-(acridin-9-ylamino)phenyl]octyl]naphthalene-1,2-dione

Systemtic Name: 4-[8-[4-(acridin-9-ylamino)phenyl]octyl]naphthalene-1,2-dione Openeye Name: 4-[8-[4-(acridin-9-ylamino)phenyl]octyl]naphthalene-1,2-dione CAS Name: 4-[8-[4-(9-acridinylamino)phenyl]octyl]naphthalene-1,2-dione IUPAC Name: 4-[8-[4-(acridin-9-ylamino)phenyl]octyl]naphthalene-1,2-dione Traditional Name: 4-[8-[4-(acridin-9-ylamino)phenyl]octyl]-1,2-naphthoquinone Formula: C37H34N2O2 MolecularWeight: 538.67806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=O)C2=O)CCCCCCCCC3=CC=C(C=C3)NC4=C5C=CC=CC5=NC6=CC=CC=C64

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=O)C2=O)CCCCCCCCC3=CC=C(C=C3)NC4=C5C=CC=CC5=NC6=CC=CC=C64

InChI

InChI=1S/C37H34N2O2/c40-35-25-27(29-15-7-8-16-30(29)37(35)41)14-6-4-2-1-3-5-13-26-21-23-28(24-22-26)38-36-31-17-9-11-19-33(31)39-34-20-12-10-18-32(34)36/h7-12,15-25H,1-6,13-14H2,(H,38,39)