methyl 5-(4-methylphenyl)pyrimido[1,6-a]indole-3-carboxylate

Systemtic Name: methyl 5-(4-methylphenyl)pyrimido[1,6-a]indole-3-carboxylate Openeye Name: methyl 5-(p-tolyl)pyrimido[1,6-a]indole-3-carboxylate CAS Name: 5-(4-methylphenyl)-3-pyrimido[1,6-a]indolecarboxylic acid methyl ester IUPAC Name: methyl 5-(4-methylphenyl)pyrimido[1,6-a]indole-3-carboxylate Traditional Name: 5-(p-tolyl)pyrimid[1,6-a]indole-3-carboxylic acid methyl ester Formula: C20H16N2O2 MolecularWeight: 316.35324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=C(N=CN3C4=CC=CC=C42)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=C(N=CN3C4=CC=CC=C42)C(=O)OC

InChI

InChI=1S/C20H16N2O2/c1-13-7-9-14(10-8-13)19-15-5-3-4-6-17(15)22-12-21-16(11-18(19)22)20(23)24-2/h3-12H,1-2H3