methyl 5-(cyclohex-3-en-1-ylmethylamino)-3-(2-methoxyethanoylamino)-1-methyl-pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 5-(cyclohex-3-en-1-ylmethylamino)-3-(2-methoxyethanoylamino)-1-methyl-pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 5-(cyclohex-3-en-1-ylmethylamino)-3-[(2-methoxyacetyl)amino]-1-methyl-pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 5-(1-cyclohex-3-enylmethylamino)-3-[(2-methoxy-1-oxoethyl)amino]-1-methyl-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-(cyclohex-3-en-1-ylmethylamino)-3-[(2-methoxyacetyl)amino]-1-methylpyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 5-(cyclohex-3-en-1-ylmethylamino)-3-[(2-methoxyacetyl)amino]-1-methyl-pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=CC(=CN=C21)NCC3CCC=CC3)NC(=O)COC)C(=O)OC

Isomeric SMILES

CN1C(=C(C2=CC(=CN=C21)NCC3CCC=CC3)NC(=O)COC)C(=O)OC

InChI

InChI=1S/C20H26N4O4/c1-24-18(20(26)28-3)17(23-16(25)12-27-2)15-9-14(11-22-19(15)24)21-10-13-7-5-4-6-8-13/h4-5,9,11,13,21H,6-8,10,12H2,1-3H3,(H,23,25)