methyl 2-ethyl-4-methyl-5-[(2-phenoxypyridin-4-yl)methylcarbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2-ethyl-4-methyl-5-[(2-phenoxypyridin-4-yl)methylcarbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-ethyl-4-methyl-5-[(2-phenoxy-4-pyridyl)methylcarbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2-ethyl-4-methyl-5-[oxo-[(2-phenoxy-4-pyridinyl)methylamino]methyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-4-methyl-5-[(2-phenoxypyridin-4-yl)methylcarbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2-ethyl-4-methyl-5-[(2-phenoxy-4-pyridyl)methylcarbamoyl]-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)NCC2=CC(=NC=C2)OC3=CC=CC=C3)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NCC2=CC(=NC=C2)OC3=CC=CC=C3)C)C(=O)OC

InChI

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