methyl 3-[(3-bromanyl-4-methoxy-phenyl)carbonylamino]-3-(3,4-dimethoxyphenyl)propanoate

Systemtic Name: methyl 3-[(3-bromanyl-4-methoxy-phenyl)carbonylamino]-3-(3,4-dimethoxyphenyl)propanoate Openeye Name: methyl 3-[(3-bromo-4-methoxy-benzoyl)amino]-3-(3,4-dimethoxyphenyl)propanoate CAS Name: 3-[[(3-bromo-4-methoxyphenyl)-oxomethyl]amino]-3-(3,4-dimethoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-[(3-bromo-4-methoxybenzoyl)amino]-3-(3,4-dimethoxyphenyl)propanoate Traditional Name: 3-[(3-bromo-4-methoxy-benzoyl)amino]-3-(3,4-dimethoxyphenyl)propionic acid methyl ester Formula: C20H22BrNO6 MolecularWeight: 452.29578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)OC)NC(=O)C2=CC(=C(C=C2)OC)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC(=O)OC)NC(=O)C2=CC(=C(C=C2)OC)Br)OC

InChI

InChI=1S/C20H22BrNO6/c1-25-16-7-6-13(9-14(16)21)20(24)22-15(11-19(23)28-4)12-5-8-17(26-2)18(10-12)27-3/h5-10,15H,11H2,1-4H3,(H,22,24)