methyl 2-ethyl-4-methyl-5-[[3-(2-oxidanylidenepiperidin-1-yl)phenyl]carbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2-ethyl-4-methyl-5-[[3-(2-oxidanylidenepiperidin-1-yl)phenyl]carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-ethyl-4-methyl-5-[[3-(2-oxo-1-piperidyl)phenyl]carbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2-ethyl-4-methyl-5-[oxo-[3-(2-oxo-1-piperidinyl)anilino]methyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-4-methyl-5-[[3-(2-oxopiperidin-1-yl)phenyl]carbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2-ethyl-5-[[3-(2-ketopiperidino)phenyl]carbamoyl]-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NC2=CC=CC(=C2)N3CCCCC3=O)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NC2=CC=CC(=C2)N3CCCCC3=O)C)C(=O)OC

InChI

InChI=1S/C21H25N3O4/c1-4-16-18(21(27)28-3)13(2)19(23-16)20(26)22-14-8-7-9-15(12-14)24-11-6-5-10-17(24)25/h7-9,12,23H,4-6,10-11H2,1-3H3,(H,22,26)