4-butoxy-8-chloranyl-5H-pyrimido[5,4-b]indole

Systemtic Name: 4-butoxy-8-chloranyl-5H-pyrimido[5,4-b]indole Openeye Name: 4-butoxy-8-chloro-5H-pyrimido[5,4-b]indole CAS Name: 4-butoxy-8-chloro-5H-pyrimido[5,4-b]indole IUPAC Name: 4-butoxy-8-chloro-5H-pyrimido[5,4-b]indole Traditional Name: 4-butoxy-8-chloro-5H-pyrimid[5,4-b]indole Formula: C14H14ClN3O MolecularWeight: 275.73346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC=NC2=C1NC3=C2C=C(C=C3)Cl

Isomeric SMILES

CCCCOC1=NC=NC2=C1NC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C14H14ClN3O/c1-2-3-6-19-14-13-12(16-8-17-14)10-7-9(15)4-5-11(10)18-13/h4-5,7-8,18H,2-3,6H2,1H3