methyl 5-bromanyl-3-[(3,4-dimethoxyphenyl)carbonylamino]-1H-indole-2-carboxylate

Systemtic Name: methyl 5-bromanyl-3-[(3,4-dimethoxyphenyl)carbonylamino]-1H-indole-2-carboxylate Openeye Name: methyl 5-bromo-3-[(3,4-dimethoxybenzoyl)amino]-1H-indole-2-carboxylate CAS Name: 5-bromo-3-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-bromo-3-[(3,4-dimethoxybenzoyl)amino]-1H-indole-2-carboxylate Traditional Name: 5-bromo-3-(veratroylamino)-1H-indole-2-carboxylic acid methyl ester Formula: C19H17BrN2O5 MolecularWeight: 433.25268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=C(NC3=C2C=C(C=C3)Br)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=C(NC3=C2C=C(C=C3)Br)C(=O)OC)OC

InChI

InChI=1S/C19H17BrN2O5/c1-25-14-7-4-10(8-15(14)26-2)18(23)22-16-12-9-11(20)5-6-13(12)21-17(16)19(24)27-3/h4-9,21H,1-3H3,(H,22,23)