methyl 2-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)carbonyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate

Systemtic Name: methyl 2-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)carbonyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Openeye Name: methyl 2-[1-phenyl-3-(3-pyridyl)pyrazole-4-carbonyl]-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate CAS Name: 2-[oxo-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methyl]-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylic acid methyl ester IUPAC Name: methyl 2-(1-phenyl-3-pyridin-3-ylpyrazole-4-carbonyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Traditional Name: 2-[1-phenyl-3-(3-pyridyl)pyrazole-4-carbonyl]-1,3,4,5-tetrahydropyrid[4,3-b]indole-8-carboxylic acid methyl ester Formula: C28H23N5O3 MolecularWeight: 477.51392

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)NC3=C2CN(CC3)C(=O)C4=CN(N=C4C5=CN=CC=C5)C6=CC=CC=C6

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)NC3=C2CN(CC3)C(=O)C4=CN(N=C4C5=CN=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C28H23N5O3/c1-36-28(35)18-9-10-24-21(14-18)22-16-32(13-11-25(22)30-24)27(34)23-17-33(20-7-3-2-4-8-20)31-26(23)19-6-5-12-29-15-19/h2-10,12,14-15,17,30H,11,13,16H2,1H3