methyl 4-[2-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[(3-bromo-4-ethoxy-5-methoxy-benzoyl)amino]ethyl]benzoate CAS Name: 4-[2-[[(3-bromo-4-ethoxy-5-methoxyphenyl)-oxomethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(3-bromo-4-ethoxy-5-methoxybenzoyl)amino]ethyl]benzoate Traditional Name: 4-[2-[(3-bromo-4-ethoxy-5-methoxy-benzoyl)amino]ethyl]benzoic acid methyl ester Formula: C20H22BrNO5 MolecularWeight: 436.29638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)NCCC2=CC=C(C=C2)C(=O)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)NCCC2=CC=C(C=C2)C(=O)OC)OC

InChI

InChI=1S/C20H22BrNO5/c1-4-27-18-16(21)11-15(12-17(18)25-2)19(23)22-10-9-13-5-7-14(8-6-13)20(24)26-3/h5-8,11-12H,4,9-10H2,1-3H3,(H,22,23)