4-(4-methoxyphenyl)-9H-pyrimido[4,5-b]indole-6-carbonitrile

Systemtic Name: 4-(4-methoxyphenyl)-9H-pyrimido[4,5-b]indole-6-carbonitrile Openeye Name: 4-(4-methoxyphenyl)-9H-pyrimido[4,5-b]indole-6-carbonitrile CAS Name: 4-(4-methoxyphenyl)-9H-pyrimido[4,5-b]indole-6-carbonitrile IUPAC Name: 4-(4-methoxyphenyl)-9H-pyrimido[4,5-b]indole-6-carbonitrile Traditional Name: 4-(4-methoxyphenyl)-9H-pyrimid[4,5-b]indole-6-carbonitrile Formula: C18H12N4O MolecularWeight: 300.31408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C3C4=C(C=CC(=C4)C#N)NC3=NC=N2

Isomeric SMILES

COC1=CC=C(C=C1)C2=C3C4=C(C=CC(=C4)C#N)NC3=NC=N2

InChI

InChI=1S/C18H12N4O/c1-23-13-5-3-12(4-6-13)17-16-14-8-11(9-19)2-7-15(14)22-18(16)21-10-20-17/h2-8,10H,1H3,(H,20,21,22)