ethyl 3-methyl-1-phenyl-pyrimido[1,6-b]indazole-4-carboxylate

Systemtic Name: ethyl 3-methyl-1-phenyl-pyrimido[1,6-b]indazole-4-carboxylate Openeye Name: ethyl 3-methyl-1-phenyl-pyrimido[1,6-b]indazole-4-carboxylate CAS Name: 3-methyl-1-phenyl-4-pyrimido[1,6-b]indazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-1-phenylpyrimido[1,6-b]indazole-4-carboxylate Traditional Name: 3-methyl-1-phenyl-pyrimid[1,6-b]indazole-4-carboxylic acid ethyl ester Formula: C20H17N3O2 MolecularWeight: 331.36788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N2C1=C3C=CC=CC3=N2)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N2C1=C3C=CC=CC3=N2)C4=CC=CC=C4)C

InChI

InChI=1S/C20H17N3O2/c1-3-25-20(24)17-13(2)21-19(14-9-5-4-6-10-14)23-18(17)15-11-7-8-12-16(15)22-23/h4-12H,3H2,1-2H3