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

Systemtic Name: methyl 2-ethyl-4-methyl-5-[[4-[(2-oxidanylidenepyridin-1-yl)methyl]phenyl]carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-ethyl-4-methyl-5-[[4-[(2-oxo-1-pyridyl)methyl]phenyl]carbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2-ethyl-4-methyl-5-[oxo-[4-[(2-oxo-1-pyridinyl)methyl]anilino]methyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-4-methyl-5-[[4-[(2-oxopyridin-1-yl)methyl]phenyl]carbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2-ethyl-5-[[4-[(2-keto-1-pyridyl)methyl]phenyl]carbamoyl]-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NC2=CC=C(C=C2)CN3C=CC=CC3=O)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NC2=CC=C(C=C2)CN3C=CC=CC3=O)C)C(=O)OC

InChI

InChI=1S/C22H23N3O4/c1-4-17-19(22(28)29-3)14(2)20(24-17)21(27)23-16-10-8-15(9-11-16)13-25-12-6-5-7-18(25)26/h5-12,24H,4,13H2,1-3H3,(H,23,27)