ethyl 3-methyl-1-(3-nitrophenyl)pyrimido[1,6-b]indazole-4-carboxylate

Systemtic Name: ethyl 3-methyl-1-(3-nitrophenyl)pyrimido[1,6-b]indazole-4-carboxylate Openeye Name: ethyl 3-methyl-1-(3-nitrophenyl)pyrimido[1,6-b]indazole-4-carboxylate CAS Name: 3-methyl-1-(3-nitrophenyl)-4-pyrimido[1,6-b]indazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-1-(3-nitrophenyl)pyrimido[1,6-b]indazole-4-carboxylate Traditional Name: 3-methyl-1-(3-nitrophenyl)pyrimid[1,6-b]indazole-4-carboxylic acid ethyl ester Formula: C20H16N4O4 MolecularWeight: 376.36544

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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)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N2C1=C3C=CC=CC3=N2)C4=CC(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C20H16N4O4/c1-3-28-20(25)17-12(2)21-19(13-7-6-8-14(11-13)24(26)27)23-18(17)15-9-4-5-10-16(15)22-23/h4-11H,3H2,1-2H3