2-methoxyethyl 5-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: 2-methoxyethyl 5-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: 2-methoxyethyl 5-[[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-methyl-carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylamino]-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 5-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylcarbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-methyl-carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid 2-methoxyethyl ester Formula: C21H26BrN3O5 MolecularWeight: 480.35224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)C2=C(C(=C(N2)C)C(=O)OCCOC)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)C2=C(C(=C(N2)C)C(=O)OCCOC)C

InChI

InChI=1S/C21H26BrN3O5/c1-12-10-15(22)6-7-16(12)24-17(26)11-25(4)20(27)19-13(2)18(14(3)23-19)21(28)30-9-8-29-5/h6-7,10,23H,8-9,11H2,1-5H3,(H,24,26)