methyl 2-[3-(1H-indol-4-yl)-5-(pyridin-3-ylamino)phenyl]benzoate

Systemtic Name: methyl 2-[3-(1H-indol-4-yl)-5-(pyridin-3-ylamino)phenyl]benzoate Openeye Name: methyl 2-[3-(1H-indol-4-yl)-5-(3-pyridylamino)phenyl]benzoate CAS Name: 2-[3-(1H-indol-4-yl)-5-(3-pyridinylamino)phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[3-(1H-indol-4-yl)-5-(pyridin-3-ylamino)phenyl]benzoate Traditional Name: 2-[3-(1H-indol-4-yl)-5-(3-pyridylamino)phenyl]benzoic acid methyl ester Formula: C27H21N3O2 MolecularWeight: 419.47454

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C2=CC(=CC(=C2)C3=C4C=CNC4=CC=C3)NC5=CN=CC=C5

Isomeric SMILES

COC(=O)C1=CC=CC=C1C2=CC(=CC(=C2)C3=C4C=CNC4=CC=C3)NC5=CN=CC=C5

InChI

InChI=1S/C27H21N3O2/c1-32-27(31)25-8-3-2-7-23(25)19-14-18(22-9-4-10-26-24(22)11-13-29-26)15-21(16-19)30-20-6-5-12-28-17-20/h2-17,29-30H,1H3