methyl 4-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]-1-methyl-pyrrolo[3,2-b]pyrrole-5-carboxylate

Systemtic Name: methyl 4-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]-1-methyl-pyrrolo[3,2-b]pyrrole-5-carboxylate Openeye Name: methyl 4-[2-(cyclohexylamino)-2-oxo-ethyl]-1-methyl-pyrrolo[3,2-b]pyrrole-5-carboxylate CAS Name: 4-[2-(cyclohexylamino)-2-oxoethyl]-1-methyl-5-pyrrolo[3,2-b]pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(cyclohexylamino)-2-oxoethyl]-1-methylpyrrolo[3,2-b]pyrrole-5-carboxylate Traditional Name: 4-[2-(cyclohexylamino)-2-keto-ethyl]-1-methyl-pyrrolo[3,2-b]pyrrole-5-carboxylic acid methyl ester Formula: C17H23N3O3 MolecularWeight: 317.38282

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=C(N2CC(=O)NC3CCCCC3)C(=O)OC

Isomeric SMILES

CN1C=CC2=C1C=C(N2CC(=O)NC3CCCCC3)C(=O)OC

InChI

InChI=1S/C17H23N3O3/c1-19-9-8-13-14(19)10-15(17(22)23-2)20(13)11-16(21)18-12-6-4-3-5-7-12/h8-10,12H,3-7,11H2,1-2H3,(H,18,21)