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

Systemtic Name: ethyl 2,4-dimethyl-5-[(2-phenoxypyridin-4-yl)methylcarbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[(2-phenoxy-4-pyridyl)methylcarbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[(2-phenoxy-4-pyridinyl)methylamino]methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[(2-phenoxypyridin-4-yl)methylcarbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[(2-phenoxy-4-pyridyl)methylcarbamoyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)NCC2=CC(=NC=C2)OC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)NCC2=CC(=NC=C2)OC3=CC=CC=C3)C

InChI

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