methyl 3-[phenyl(5H-pyrimido[5,4-b]indol-4-yl)amino]propanoate

Systemtic Name: methyl 3-[phenyl(5H-pyrimido[5,4-b]indol-4-yl)amino]propanoate Openeye Name: methyl 3-[N-(5H-pyrimido[5,4-b]indol-4-yl)anilino]propanoate CAS Name: 3-[N-(5H-pyrimido[5,4-b]indol-4-yl)anilino]propanoic acid methyl ester IUPAC Name: methyl 3-[N-(5H-pyrimido[5,4-b]indol-4-yl)anilino]propanoate Traditional Name: 3-[N-(5H-pyrimid[5,4-b]indol-4-yl)anilino]propionic acid methyl ester Formula: C20H18N4O2 MolecularWeight: 346.38252

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN(C1=CC=CC=C1)C2=NC=NC3=C2NC4=CC=CC=C43

Isomeric SMILES

COC(=O)CCN(C1=CC=CC=C1)C2=NC=NC3=C2NC4=CC=CC=C43

InChI

InChI=1S/C20H18N4O2/c1-26-17(25)11-12-24(14-7-3-2-4-8-14)20-19-18(21-13-22-20)15-9-5-6-10-16(15)23-19/h2-10,13,23H,11-12H2,1H3