7,8-dimethoxy-N-(2-methoxy-5-nitro-phenyl)-5H-pyrimido[5,4-b]indol-4-amine

Systemtic Name: 7,8-dimethoxy-N-(2-methoxy-5-nitro-phenyl)-5H-pyrimido[5,4-b]indol-4-amine Openeye Name: 7,8-dimethoxy-N-(2-methoxy-5-nitro-phenyl)-5H-pyrimido[5,4-b]indol-4-amine CAS Name: 7,8-dimethoxy-N-(2-methoxy-5-nitrophenyl)-5H-pyrimido[5,4-b]indol-4-amine IUPAC Name: 7,8-dimethoxy-N-(2-methoxy-5-nitrophenyl)-5H-pyrimido[5,4-b]indol-4-amine Traditional Name: (7,8-dimethoxy-5H-pyrimid[5,4-b]indol-4-yl)-(2-methoxy-5-nitro-phenyl)amine Formula: C19H17N5O5 MolecularWeight: 395.36878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC2=NC=NC3=C2NC4=CC(=C(C=C43)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC2=NC=NC3=C2NC4=CC(=C(C=C43)OC)OC

InChI

InChI=1S/C19H17N5O5/c1-27-14-5-4-10(24(25)26)6-13(14)23-19-18-17(20-9-21-19)11-7-15(28-2)16(29-3)8-12(11)22-18/h4-9,22H,1-3H3,(H,20,21,23)