1-[(9-methoxy-5H-pyrimido[5,4-b]indol-4-yl)amino]anthracene-9,10-dione

Systemtic Name: 1-[(9-methoxy-5H-pyrimido[5,4-b]indol-4-yl)amino]anthracene-9,10-dione Openeye Name: 1-[(9-methoxy-5H-pyrimido[5,4-b]indol-4-yl)amino]anthracene-9,10-dione CAS Name: 1-[(9-methoxy-5H-pyrimido[5,4-b]indol-4-yl)amino]anthracene-9,10-dione IUPAC Name: 1-[(9-methoxy-5H-pyrimido[5,4-b]indol-4-yl)amino]anthracene-9,10-dione Traditional Name: 1-[(9-methoxy-5H-pyrimid[5,4-b]indol-4-yl)amino]-9,10-anthraquinone Formula: C25H16N4O3 MolecularWeight: 420.41954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C3=C(N2)C(=NC=N3)NC4=CC=CC5=C4C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

COC1=CC=CC2=C1C3=C(N2)C(=NC=N3)NC4=CC=CC5=C4C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C25H16N4O3/c1-32-18-11-5-10-17-20(18)21-22(28-17)25(27-12-26-21)29-16-9-4-8-15-19(16)24(31)14-7-3-2-6-13(14)23(15)30/h2-12,28H,1H3,(H,26,27,29)