methyl 3-acetamido-5-[(1-ethanoylpiperidin-4-yl)amino]-1-(oxolan-2-ylmethyl)pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 3-acetamido-5-[(1-ethanoylpiperidin-4-yl)amino]-1-(oxolan-2-ylmethyl)pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 3-acetamido-5-[(1-acetyl-4-piperidyl)amino]-1-(tetrahydrofuran-2-ylmethyl)pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 3-acetamido-5-[(1-acetyl-4-piperidinyl)amino]-1-(2-oxolanylmethyl)-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-acetamido-5-[(1-acetylpiperidin-4-yl)amino]-1-(oxolan-2-ylmethyl)pyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 3-acetamido-5-[(1-acetyl-4-piperidyl)amino]-1-(tetrahydrofurfuryl)pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C23H31N5O5 MolecularWeight: 457.52274

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(N(C2=NC=C(C=C12)NC3CCN(CC3)C(=O)C)CC4CCCO4)C(=O)OC

Isomeric SMILES

CC(=O)NC1=C(N(C2=NC=C(C=C12)NC3CCN(CC3)C(=O)C)CC4CCCO4)C(=O)OC

InChI

InChI=1S/C23H31N5O5/c1-14(29)25-20-19-11-17(26-16-6-8-27(9-7-16)15(2)30)12-24-22(19)28(21(20)23(31)32-3)13-18-5-4-10-33-18/h11-12,16,18,26H,4-10,13H2,1-3H3,(H,25,29)