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

Systemtic Name: ethyl 1-methyl-4-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]pyrrolo[3,2-b]pyrrole-5-carboxylate Openeye Name: ethyl 1-methyl-4-[2-(3-methyl-1-piperidyl)-2-oxo-ethyl]pyrrolo[3,2-b]pyrrole-5-carboxylate CAS Name: 1-methyl-4-[2-(3-methyl-1-piperidinyl)-2-oxoethyl]-5-pyrrolo[3,2-b]pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-4-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]pyrrolo[3,2-b]pyrrole-5-carboxylate Traditional Name: 4-[2-keto-2-(3-methylpiperidino)ethyl]-1-methyl-pyrrolo[3,2-b]pyrrole-5-carboxylic acid ethyl ester Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1CC(=O)N3CCCC(C3)C)C=CN2C

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1CC(=O)N3CCCC(C3)C)C=CN2C

InChI

InChI=1S/C18H25N3O3/c1-4-24-18(23)16-10-15-14(7-9-19(15)3)21(16)12-17(22)20-8-5-6-13(2)11-20/h7,9-10,13H,4-6,8,11-12H2,1-3H3