methyl 3-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonylamino]-4-methyl-benzoate Openeye Name: methyl 3-[(3-bromo-4-ethoxy-5-methoxy-benzoyl)amino]-4-methyl-benzoate CAS Name: 3-[[(3-bromo-4-ethoxy-5-methoxyphenyl)-oxomethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[(3-bromo-4-ethoxy-5-methoxybenzoyl)amino]-4-methylbenzoate Traditional Name: 3-[(3-bromo-4-ethoxy-5-methoxy-benzoyl)amino]-4-methyl-benzoic acid methyl ester Formula: C19H20BrNO5 MolecularWeight: 422.2698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)NC2=C(C=CC(=C2)C(=O)OC)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)NC2=C(C=CC(=C2)C(=O)OC)C)OC

InChI

InChI=1S/C19H20BrNO5/c1-5-26-17-14(20)8-13(10-16(17)24-3)18(22)21-15-9-12(19(23)25-4)7-6-11(15)2/h6-10H,5H2,1-4H3,(H,21,22)