methyl 4-[4-(4-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)piperazin-1-yl]benzoate

Systemtic Name: methyl 4-[4-(4-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)piperazin-1-yl]benzoate Openeye Name: methyl 4-[4-(4-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)piperazin-1-yl]benzoate CAS Name: 4-[4-(4-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)-1-piperazinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(4-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)piperazin-1-yl]benzoate Traditional Name: 4-[4-(4-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)piperazino]benzoic acid methyl ester Formula: C20H22N4O2 MolecularWeight: 350.41428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CNC2=NC=C1N3CCN(CC3)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=C2C=CNC2=NC=C1N3CCN(CC3)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C20H22N4O2/c1-14-17-7-8-21-19(17)22-13-18(14)24-11-9-23(10-12-24)16-5-3-15(4-6-16)20(25)26-2/h3-8,13H,9-12H2,1-2H3,(H,21,22)