methyl 3-benzamido-5-[(1-methoxy-1-oxidanylidene-propan-2-yl)amino]-1-(oxolan-2-ylmethyl)pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 3-benzamido-5-[(1-methoxy-1-oxidanylidene-propan-2-yl)amino]-1-(oxolan-2-ylmethyl)pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 3-benzamido-5-[(2-methoxy-1-methyl-2-oxo-ethyl)amino]-1-(tetrahydrofuran-2-ylmethyl)pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 3-benzamido-5-[(1-methoxy-1-oxopropan-2-yl)amino]-1-(2-oxolanylmethyl)-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-benzamido-5-[(1-methoxy-1-oxopropan-2-yl)amino]-1-(oxolan-2-ylmethyl)pyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 3-benzamido-5-[(2-keto-2-methoxy-1-methyl-ethyl)amino]-1-(tetrahydrofurfuryl)pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C25H28N4O6 MolecularWeight: 480.51302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC1=CN=C2C(=C1)C(=C(N2CC3CCCO3)C(=O)OC)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)OC)NC1=CN=C2C(=C1)C(=C(N2CC3CCCO3)C(=O)OC)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H28N4O6/c1-15(24(31)33-2)27-17-12-19-20(28-23(30)16-8-5-4-6-9-16)21(25(32)34-3)29(22(19)26-13-17)14-18-10-7-11-35-18/h4-6,8-9,12-13,15,18,27H,7,10-11,14H2,1-3H3,(H,28,30)